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Quantum-centric supercomputing for materials science: A perspective on challenges and future directions 以量子为中心的材料科学超级计算: 挑战和未来方向 Alexeev, Yuri; Amsler, Maximilian; Barroca, Marco Antonio; Bassini, Sanzio; Battelle, Torey; Camps, Daan; Casanova, David; Choi, Young Jay; Chong, Frederic T.; Chung, Charles; Codella, Christopher; Corcoles, Antonio D.; Cruise, James; Di Meglio, Alberto; Duran, Ivan; Eckl, Thomas; Economou, Sophia; Eidenbenz, Stephan; Elmegreen, Bruce; Fare, Clyde; Faro, Ismael; Fernandez, Cristina Sanz; Ferreira, Rodrigo Neumann Barros; Fuji, Keisuke; Fuller, Bryce; Gagliardi, Laura; Galli, Giulia; Glick, Jennifer R.; Gobbi, Isacco; Gokhale, Pranav; Gonzalez, Salvador de la Puente; Greiner, Johannes; Gropp, Bill; Grossi, Michele; Gull, Emanuel; Healy, Burns; Hermes, Matthew R.; Huang, Benchen; Humble, Travis S.; Ito, Nobuyasu; Izmaylov, Artur F.; Javadi-Abhari, Ali; Jennewein, Douglas; Jha, Shantenu; Jiang, Liang; Jones, Barbara; de Jong, Wibe Albert; Jurcevic, Petar; Kirby, William; Kister, Stefan; Kitagawa, Masahiro; Klassen, Joel; Klymko, Katherine; Koh, Kwangwon; Kondo, Masaaki; Kurkcuoglu, Doga Murat; Kurowski, Krzysztof; Laino, Teodoro; Landfield, Ryan; Leininger, Matt; Leyton-Ortega, Vicente; Li, Ang; Lin, Meifeng; Liu, Junyu; Lorente, Nicolas; Luckow, Andre; Martiel, Simon; Martin-Fernandez, Francisco; Martonosi, Margaret; Marvinney, Claire; Medina, Arcesio Castaneda; Merten, Dirk; Mezzacapo, Antonio; Michielsen, Kristel; Mitra, Abhishek; Mittal, Tushar; Moon, Kyungsun; Moore, Joel; Mostame, Sarah; Motta, Mario; Na, Young-Hye; Nam, Yunseong; Narang, Prineha; Ohnishi, Yu-ya; Ottaviani, Daniele; Otten, Matthew; Pakin, Scott; Pascuzzi, Vincent R.; Pednault, Edwin; Piontek, Tomasz; Pitera, Jed; Rall, Patrick; Ravi, Gokul Subramanian; Robertson, Niall; Rossi, Matteo A. C.; Rydlichowski, Piotr; Ryu, Hoon; Samsonidze, Georgy; Sato, Mitsuhisa; Saurabh, Nishant; Sharma, Vidushi; Sharma, Kunal; Shin, Soyoung; Slessman, George; Steiner, Mathias; Sitdikov, Iskandar; Suh, In-Saeng; Switzer, Eric D.; Tang, Wei; Thompson, Joel; Todo, Synge; Tran, Minh C.; Trenev, Dimitar; Trott, Christian; Tseng, Huan-Hsin; Tubman, Norm M.; Tureci, Esin; Valinas, David Garcia; Vallecorsa, Sofia; Wever, Christopher; Wojciechowski, Konrad; Wu, Xiaodi; Yoo, Shinjae; Yoshioka, Nobuyuki; Yu, Victor Wen-zhe; Yunoki, Seiji; Zhuk, Sergiy; Zubarev, Dmitry 分享 收藏
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Classical and quantum trial wave functions in auxiliary-field quantum Monte Carlo applied to oxygen allotropes and a CuBr2 model system Amsler, Maximilian; Deglmann, Peter; Degroote, Matthias; Kaicher, Michael P.; Kiser, Matthew; Kuehn, Michael; Kumar, Chandan; Maier, Andreas; Samsonidze, Georgy; Schroeder, Anna; Streif, Michael; Vodola, Davide; Wever, Christopher 分享 收藏
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Autonomous materials synthesis via hierarchical active learning of nonequilibrium phase diagrams 通过非平衡相图的分层主动学习进行自主材料合成 Ament, Sebastian; Amsler, Maximilian; Sutherland, Duncan R.; Chang, Ming-Chiang; Guevarra, Dan; Connolly, Aine B.; Gregoire, John M.; Thompson, Michael O.; Gomes, Carla P.; van Dover, R. Bruce 分享 收藏
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Evidence for carbon clusters present near thermal gate oxides affecting the electronic band structure in SiC-MOSFET Dutta, D.; De, D. S.; Fan, D.; Roy, S.; Alfieri, G.; Camarda, M.; Amsler, M.; Lehmann, J.; Bartolf, H.; Goedecker, S.; Jung, T. A. 分享 收藏
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Crystal structure, energetics, and phase stability of strengthening precipitates in Mg alloys: A first-principles study Mg合金中强化析出物的晶体结构，能量学和相稳定性: 第一性原理研究 Wang, Dongshu; Amsler, Maximilian; Hegde, Vinay I.; Saal, James E.; Issa, Ahmed; Zhou, Bi-Cheng; Zeng, Xiaoqin; Wolverton, Chris 分享 收藏
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