Volume 7, Issue 4 April 2023 | | Advertisement Join the APS Division of Laser Science and representatives from the Physical Review Journals at booth #409 during CLEO 2023. Play the Prize Drop game and win an exciting prize! And don't miss our Meet the Physical Review Journal Editors event, to be held Tuesday, May 9, 1:15 p.m. – 1:45 p.m. on the Show Floor Theatre. Discuss your latest submission or learn how to become a referee. | | | | | Advertisement Registration is open for APS's Division of Atomic, Molecular and Optical Physics Meeting, to be held June 5-9 in Spokane, WA. Witness groundbreaking physics research, attend engaging events, and network with colleagues. Early bird registration rates end May 5. Register today. | | | | | Advertisement PRL seeks two Associate Editors to handle all phases of the peer review process and ultimately decide which papers are published. Dynamic and personable individuals with a strong scientific background in either condensed matter and materials science, or physics of fluids, polymer physics, chemical physics, geophysics, or complex systems are encouraged to apply. More information. | | | | | Not an APS member? Join today to start connecting with a community of more than 50,000 physicists. | | | | Editors' Suggestion Hanjing Zhou, Songsong Yan, Lin Wu, Xiangang Wan, and Di Wang Phys. Rev. Materials 7, 044405 (2023) – Published 11 April 2023 | High-performance permanent magnets, which have a wide range of applications in the information age, are characterized by significant magnetic anisotropy mainly affected by spin-orbit coupling (SOC). The authors perform a highly efficient search for permanent magnet materials in the inorganic crystal structure database by focusing on materials containing 3d transition elements with specific Wyckoff positions, where certain partially occupied orbital multiplets can significantly enhance the effect of SOC. According to common standards of permanent magnets, the authors propose five new permanent magnet candidates. They believe that these potential permanent magnet materials deserve further experimental study. | | | | | | Editors' Suggestion Kevin F. Garrity and Kamal Choudhary Phys. Rev. Materials 7, 044603 (2023) – Published 14 April 2023 | Parametrized tight-binding is a computationally efficient way to calculate a material's energy and electronic structure, but a lack of well-tested and quantitatively accurate parameter sets limits potential applications. Here, the authors develop a model that uses both two-body and three-body contributions to predict tight-binding Hamiltonians directly from crystal structures. They fit the model to a large database of density functional theory calculations of elemental and binary materials from sixty-four main group and transition metal atoms, using an active learning procedure to generate and test out-of-sample structures. The resulting parameter set enables fast and accurate materials calculations. | | | | | | Editors' Suggestion Anna O. Schouten, Jordan E. Klevens, LeeAnn M. Sager-Smith, Jiaze Xie, John S. Anderson, and David A. Mazziotti Phys. Rev. Materials 7, 045001 (2023) – Published 10 April 2023 | An outstanding challenge is to develop molecular materials that exhibit highly efficient energy transfer at ambient conditions. The authors of this study demonstrate the potential of an amorphous material to become an exciton condensate, in which energy can flow with minimal frictional loss. Unlike the Bechgaard salts that support superconductivity only at high pressures, the authors show that the amorphous polymer NiTTFtt, recently synthesized by Xie and Anderson, exhibits the computational signature of exciton condensation at atmospheric pressure and its synthetic geometry. This research supports the realistic possibility of harnessing chemical tunability to achieve "strongly correlated" phenomena at more ambient conditions, opening novel avenues for superefficient energy transfer in technologically relevant materials. | | | | | | Editors' Suggestion Letter Sarah Battat, Amit A. Nagarkar, Frans Spaepen, David A. Weitz, and George M. Whitesides Phys. Rev. Materials 7, L040401 (2023) – Published 13 April 2023 | This paper describes the formation kinetics of a two-dimensional, binary Coulombic material. The material is formed by mechanically agitating millimeter-sized nylon and polytetrafluoroethylene (PTFE) beads that tribocharge positively and negatively, respectively. The authors alter the relative number of nylon and PTFE beads, without changing their combined total. They discover a common transient structure that does not depend on the relative ratio of nylon and PTFE beads, reveal a structure transition driven by the minimization of Coulombic energy, and provide insights for the rational design of materials. | | | | | | Crystal growth, crystallization, and kinetics | Editors' Suggestion Letter Sarah Battat, Amit A. Nagarkar, Frans Spaepen, David A. Weitz, and George M. Whitesides Phys. Rev. Materials 7, L040401 (2023) – Published 13 April 2023 | This paper describes the formation kinetics of a two-dimensional, binary Coulombic material. The material is formed by mechanically agitating millimeter-sized nylon and polytetrafluoroethylene (PTFE) beads that tribocharge positively and negatively, respectively. The authors alter the relative number of nylon and PTFE beads, without changing their combined total. They discover a common transient structure that does not depend on the relative ratio of nylon and PTFE beads, reveal a structure transition driven by the minimization of Coulombic energy, and provide insights for the rational design of materials. | | | | | | Two-dimensional materials | Letter Klara Volckaert, Byoung Ki Choi, Hyuk Jin Kim, Deepnarayan Biswas, Denny Puntel, Simone Peli, Fulvio Parmigiani, Federico Cilento, Young Jun Chang, and Søren Ulstrup Phys. Rev. Materials 7, L041001 (2023) – Published 25 April 2023 | | | Superconducting materials | Letter Haoyuan Zhong, Hongyun Zhang, Haoxiong Zhang, Ting Bao, Kenan Zhang, Shengnan Xu, Laipeng Luo, Awabaikeli Rousuli, Wei Yao, Jonathan D. Denlinger, Yaobo Huang, Yang Wu, Yong Xu, Wenhui Duan, and Shuyun Zhou Phys. Rev. Materials 7, L041801 (2023) – Published 26 April 2023 | | | Structural and mechanical properties | Mashroor S. Nitol, Khanh Dang, Saryu J. Fensin, Michael I. Baskes, Doyl E. Dickel, and Christopher D. Barrett Phys. Rev. Materials 7, 043601 (2023) – Published 3 April 2023 | | | Heyu Zhu, Jiantao Wang, Yun Chen, Mingfeng Liu, Hui Ma, Yan Sun, Peitao Liu, and Xing-Qiu Chen Phys. Rev. Materials 7, 043602 (2023) – Published 11 April 2023 | | | F. J. Domínguez-Gutiérrez, P. Grigorev, A. Naghdi, J. Byggmästar, G. Y. Wei, T. D. Swinburne, S. Papanikolaou, and M. J. Alava Phys. Rev. Materials 7, 043603 (2023) – Published 24 April 2023 | | | Kazuki Nagai, Masato Anada, Kazuhiro Kowa, Miho Kitamura, Hiroshi Kumigashira, Hiroo Tajiri, and Yusuke Wakabayashi Phys. Rev. Materials 7, 043604 (2023) – Published 26 April 2023 | | | Development of new methods for materials | Yury Lysogorskiy, Anton Bochkarev, Matous Mrovec, and Ralf Drautz Phys. Rev. Materials 7, 043801 (2023) – Published 12 April 2023 | | | Dishant Beniwal and Pratik K. Ray Phys. Rev. Materials 7, 043802 (2023) – Published 21 April 2023 | | | Two-dimensional materials | Desman Perdamaian Gulo, Nguyen Tuan Hung, Raman Sankar, Riichiro Saito, and Hsiang-Lin Liu Phys. Rev. Materials 7, 044001 (2023) – Published 5 April 2023 | | | Bin Lei, Shihao Liu, Donghui Ma, Weizhuang Zhuo, Wenxiang Wang, Chuanqiang Wu, Binghui Ge, Jianjun Ying, Ziji Xiang, Tao Wu, Zhenyu Wang, and Xianhui Chen Phys. Rev. Materials 7, 044002 (2023) – Published 10 April 2023 | | | Bryan W. Reed, Catherine Tran, and Kristie J. Koski Phys. Rev. Materials 7, 044003 (2023) – Published 12 April 2023 | | | Bharti Parashar, Lars Rathmann, Hyun-Jung Kim, Iulia Cojocariu, Aaron Bostwick, Chris Jozwiak, Eli Rotenberg, José Avila, Pavel Dudin, Vitaliy Feyer, Christoph Stampfer, Bernd Beschoten, Gustav Bihlmayer, Claus M. Schneider, and Lukasz Plucinski Phys. Rev. Materials 7, 044004 (2023) – Published 14 April 2023 | | | Anamul Md. Hoque, Vasudev Ramachandra, Antony George, Emad Najafidehaghani, Ziyang Gan, Richa Mitra, Bing Zhao, Dmitrii Khokhriakov, Andrey Turchanin, Samuel Lara-Avila, Sergey Kubatkin, and Saroj P. Dash Phys. Rev. Materials 7, 044005 (2023) – Published 24 April 2023 | | | Topological and Dirac materials | Kristupas Kazimieras Tikuišis, Adam Dubroka, Klára Uhlířová, Florian Speck, Thomas Seyller, Maria Losurdo, Milan Orlita, and Martin Veis Phys. Rev. Materials 7, 044201 (2023) – Published 17 April 2023 | | | Sabin Regmi, Robert Smith, Anup Pradhan Sakhya, Milo Sprague, Mazharul Islam Mondal, Iftakhar Bin Elius, Nathan Valadez, Andrzej Ptok, Dariusz Kaczorowski, and Madhab Neupane Phys. Rev. Materials 7, 044202 (2023) – Published 20 April 2023 | | | Tyger H. Salters, Fabio Orlandi, Tanya Berry, Jason F. Khoury, Ethan Whittaker, Pascal Manuel, and Leslie M. Schoop Phys. Rev. Materials 7, 044203 (2023) – Published 26 April 2023 | | | Magnetic, ferroelectric, and multiferroic materials | Simon A. Meynell, Yolita M. Eggeler, Joshua D. Bocarsly, Daniil A. Kitchaev, Bailey E. Rhodes, Tresa M. Pollock, Stephen D. Wilson, Anton Van der Ven, Ram Seshadri, Marc De Graef, Ania Bleszynski Jayich, and Daniel S. Gianola Phys. Rev. Materials 7, 044401 (2023) – Published 3 April 2023 | | | Alan Farhan, Maria Cocconcelli, Federico Stramaglia, Nikolai Kuznetsov, Lukáš Flajšman, Marcus Wyss, Lide Yao, Cinthia Piamonteze, and Sebastiaan van Dijken Phys. Rev. Materials 7, 044402 (2023) – Published 7 April 2023 | | | Aleksei Egorov, Aparna P. A. Subramanyam, Ziyi Yuan, Ralf Drautz, and Thomas Hammerschmidt Phys. Rev. Materials 7, 044403 (2023) – Published 10 April 2023 | | | A. Mouhoub, F. Millo, C. Chappert, J.-V. Kim, J. Létang, A. Solignac, and T. Devolder Phys. Rev. Materials 7, 044404 (2023) – Published 10 April 2023 | | | Editors' Suggestion Hanjing Zhou, Songsong Yan, Lin Wu, Xiangang Wan, and Di Wang Phys. Rev. Materials 7, 044405 (2023) – Published 11 April 2023 | High-performance permanent magnets, which have a wide range of applications in the information age, are characterized by significant magnetic anisotropy mainly affected by spin-orbit coupling (SOC). The authors perform a highly efficient search for permanent magnet materials in the inorganic crystal structure database by focusing on materials containing 3d transition elements with specific Wyckoff positions, where certain partially occupied orbital multiplets can significantly enhance the effect of SOC. According to common standards of permanent magnets, the authors propose five new permanent magnet candidates. They believe that these potential permanent magnet materials deserve further experimental study. | | | | | | Zhixue Shu, Haozhe Wang, Na Hyun Jo, Chris Jozwiak, Aaron Bostwick, Eli Rotenberg, Weiwei Xie, and Tai Kong Phys. Rev. Materials 7, 044406 (2023) – Published 12 April 2023 | | | Sékou-Oumar Kaba, Benjamin Groleau-Paré, Marc-Antoine Gauthier, A.-M. S. Tremblay, Simon Verret, and Chloé Gauvin-Ndiaye Phys. Rev. Materials 7, 044407 (2023) – Published 14 April 2023 | | | Ali Muhammad Malik, Jochen Rohrer, and Karsten Albe Phys. Rev. Materials 7, 044408 (2023) – Published 17 April 2023 | | | Oleksandr I. Malyi and Alex Zunger Phys. Rev. Materials 7, 044409 (2023) – Published 18 April 2023 | | | B. S. Jacobs and Abhishek Pandey Phys. Rev. Materials 7, 044410 (2023) – Published 21 April 2023 | | | Xiang Chen, Wei Tian, Yu He, Hongrui Zhang, Tyler L. Werner, Saul Lapidus, Jacob P. C. Ruff, Ramamoorthy Ramesh, and Robert J. Birgeneau Phys. Rev. Materials 7, 044411 (2023) – Published 24 April 2023 | | | Tengfei Cao, Guodong Ren, Ding-Fu Shao, Evgeny Y. Tsymbal, and Rohan Mishra Phys. Rev. Materials 7, 044412 (2023) – Published 24 April 2023 | | | Yosuke Nonaka, Yuki K. Wakabayashi, Goro Shibata, Shoya Sakamoto, Keisuke Ikeda, Zhendong Chi, Yuxuan Wan, Masahiro Suzuki, Arata Tanaka, Masaaki Tanaka, and Atsushi Fujimori Phys. Rev. Materials 7, 044413 (2023) – Published 27 April 2023 | | | Jonas A. Krieger, Daniel Tay, Igor P. Rusinov, Sourabh Barua, Pabitra K. Biswas, Lukas Korosec, Thomas Prokscha, Thorsten Schmitt, Niels B. M. Schröter, Tian Shang, Toni Shiroka, Andreas Suter, Geetha Balakrishnan, Evgueni V. Chulkov, Vladimir N. Strocov, and Zaher Salman Phys. Rev. Materials 7, 044414 (2023) – Published 28 April 2023 | | | Jialin Tang, Guotai Li, Qi Wang, Jiongzhi Zheng, Lin Cheng, and Ruiqiang Guo Phys. Rev. Materials 7, 044601 (2023) – Published 10 April 2023 | | | Matan Menahem, Nimrod Benshalom, Maor Asher, Sigalit Aharon, Roman Korobko, Olle Hellman, and Omer Yaffe Phys. Rev. Materials 7, 044602 (2023) – Published 11 April 2023 | | | Editors' Suggestion Kevin F. Garrity and Kamal Choudhary Phys. Rev. Materials 7, 044603 (2023) – Published 14 April 2023 | Parametrized tight-binding is a computationally efficient way to calculate a material's energy and electronic structure, but a lack of well-tested and quantitatively accurate parameter sets limits potential applications. Here, the authors develop a model that uses both two-body and three-body contributions to predict tight-binding Hamiltonians directly from crystal structures. They fit the model to a large database of density functional theory calculations of elemental and binary materials from sixty-four main group and transition metal atoms, using an active learning procedure to generate and test out-of-sample structures. The resulting parameter set enables fast and accurate materials calculations. | | | | | | San-Dong Guo, Jing-Xin Zhu, Guang-Zhao Wang, Hao-Tian Guo, Bing Wang, Kai Cheng, and Yee Sin Ang Phys. Rev. Materials 7, 044604 (2023) – Published 14 April 2023 | | | Johan Klarbring, Utkarsh Singh, Sergei I. Simak, and Igor A. Abrikosov Phys. Rev. Materials 7, 044605 (2023) – Published 14 April 2023 | | | Superconducting materials | Ming-Cui Ding, Bing-Ying Pan, Gang Zhao, and Yu-Zhong Zhang Phys. Rev. Materials 7, 044801 (2023) – Published 3 April 2023 | | | Luis Craco and Stefano Leoni Phys. Rev. Materials 7, 044802 (2023) – Published 18 April 2023 | | | Other electronic materials | Editors' Suggestion Anna O. Schouten, Jordan E. Klevens, LeeAnn M. Sager-Smith, Jiaze Xie, John S. Anderson, and David A. Mazziotti Phys. Rev. Materials 7, 045001 (2023) – Published 10 April 2023 | An outstanding challenge is to develop molecular materials that exhibit highly efficient energy transfer at ambient conditions. The authors of this study demonstrate the potential of an amorphous material to become an exciton condensate, in which energy can flow with minimal frictional loss. Unlike the Bechgaard salts that support superconductivity only at high pressures, the authors show that the amorphous polymer NiTTFtt, recently synthesized by Xie and Anderson, exhibits the computational signature of exciton condensation at atmospheric pressure and its synthetic geometry. This research supports the realistic possibility of harnessing chemical tunability to achieve "strongly correlated" phenomena at more ambient conditions, opening novel avenues for superefficient energy transfer in technologically relevant materials. | | | | | | Thorsten Schultz, Peer Bärmann, Elena Longhi, Rahul Meena, Yves Geerts, Yury Gogotsi, Stephen Barlow, Seth R. Marder, Tristan Petit, and Norbert Koch Phys. Rev. Materials 7, 045002 (2023) – Published 12 April 2023 | | | Diana Lucia Quintero-Castro, Gøran J. Nilsen, Katrin Meier-Kirchner, Angelica Benitez-Castro, Gerrit Guenther, Toshiro Sakakibara, Masashi Tokunaga, Chidozie Agu, Ipsita Mandal, and Alexander A. Tsirlin Phys. Rev. Materials 7, 045003 (2023) – Published 17 April 2023 | | | Metamaterials, optical, photonic, and plasmonic materials | D. Quang To, Weipeng Wu, Subhash Bhatt, Yongchen Liu, Anderson Janotti, Joshua M. O. Zide, Mark J. H. Ku, John Q. Xiao, M. Benjamin Jungfleisch, Stephanie Law, and Matthew F. Doty Phys. Rev. Materials 7, 045201 (2023) – Published 20 April 2023 | | | Materials for energy harvesting, storage, and generation | Hongbin Xu, Dongying Li, Mingsen Deng, Xuefei Liu, Zhenzhen Feng, and Wentao Wang Phys. Rev. Materials 7, 045401 (2023) – Published 14 April 2023 | | | Ashutosh Kumar, Preeti Bhumla, Duraisamy Sivaprahasam, Saswata Bhattacharya, and Nita Dragoe Phys. Rev. Materials 7, 045402 (2023) – Published 19 April 2023 | | | Feiyu Xu, Brandon Wagner, Pankaj Ghildiyal, Lorenzo Mangolini, and Michael R. Zachariah Phys. Rev. Materials 7, 045403 (2023) – Published 24 April 2023 | | | Soft, molecular, and amorphous materials | Brenden W. Hamilton and Alejandro Strachan Phys. Rev. Materials 7, 045601 (2023) – Published 18 April 2023 | | | Jun Jiang, Xiang-Guo Li, Alec S. Mishkin, Rui Zhang, Riccardo Bassiri, James N. Fry, Martin M. Fejer, and Hai-Ping Cheng Phys. Rev. Materials 7, 045602 (2023) – Published 20 April 2023 | | | Gregory M. Grason and Edwin L. Thomas Phys. Rev. Materials 7, 045603 (2023) – Published 21 April 2023 | Supramolecular crystal phases of self-assembled soft matter share the symmetries of atomic and molecular crystals, but with vastly larger unit cells occupied by huge numbers of flexible molecules. Recent progress in understanding the formation of complex crystals of quasi-spherical soft matter domains derives from a mesoatomic analogy. In this analogy, the ultimate structure is broken down into micelle-like motifs, whose shape, size, and packing dictate thermodynamics. This begs a basic question for complex network phases, such as the double-gyroid: what are the mesoatomic "building blocks" of crystals with non-convex, polycontinuous, and inter-catenated domains? Here, the authors propose generic principles for divining the mesoatomic building blocks of network crystals and illustrate these principles for double-networks of diblock copolymers. They also propose and explore a minimal physical model for how mesoatomic shapes and packing can template a rich dynamics for the assembly and link formation of inter-catenating soft matter crystals. | | | | | | Luigi Giacomazzi, Nikita S. Shcheblanov, Mikhail E. Povarnitsyn, Yanbo Li, Andraž Mavrič, Barbara Zupančič, Jože Grdadolnik, and Alfredo Pasquarello Phys. Rev. Materials 7, 045604 (2023) – Published 24 April 2023 | | | Kazu Hirosawa, Tatsuhiro Iwama, Naoki Sakamoto, Hiroyasu Masunaga, and Taiki Hoshino Phys. Rev. Materials 7, 045605 (2023) – Published 26 April 2023 | | | Materials for catalysis and electrochemistry | Jan Beckord, J. Trey Diulus, Zbynek Novotny, Jürg Osterwalder, and Matthias Hengsberger Phys. Rev. Materials 7, 045801 (2023) – Published 6 April 2023 | | | Nataliya Lopanitsyna, Guillaume Fraux, Maximilian A. Springer, Sandip De, and Michele Ceriotti Phys. Rev. Materials 7, 045802 (2023) – Published 26 April 2023 | | | Andrea Grisafi and Federico Grasselli Phys. Rev. Materials 7, 045803 (2023) – Published 27 April 2023 | | | | |
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