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Phase Change-Mediated Capture of Carbon Dioxide from Air with a Molecular Triamine Network Solid 通过分子三胺网络固体的相变介导从空气中捕获二氧化碳 Huang, Adrian J.; Gupta, Ankur K.; Jiang, Henry Z. H.; Zhuang, Hao; Wenny, Malia B.; Klein, Ryan A.; Kwon, Hyunchul; Meihaus, Katie R.; Furukawa, Hiroyasu; Brown, Craig M.; Reimer, Jeffrey A.; de Jong, Wibe A. 分享 收藏
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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Inverse Design of Photonic Surfaces via High throughput Femtosecond Laser Processing and Tandem Neural Networks 通过高通量飞秒激光加工和串联神经网络对光子表面进行逆设计 Park, Minok; Grbcic, Luka; Motameni, Parham; Song, Spencer; Singh, Alok; Malagrino, Dante; Elzouka, Mahmoud; Vahabi, Puya H.; Todeschini, Alberto; de Jong, Wibe Albert; Prasher, Ravi; Zorba, Vassilia; Lubner, Sean D. 分享 收藏
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4f-Orbital mixing increases the magnetic susceptibility of Cp′3EU Gunther, S. Olivia; Qiao, Yusen; Smith, Patrick W.; Ciccone, Sierra R.; Ditter, Alexander S.; Huh, Daniel N.; Moreau, Liane M.; Shuh, David K.; Sun, Taoxiang; Arnold, Polly L.; Booth, Corwin H.; de Jong, Wibe A.; Evans, William J.; Lukens Jr, Wayne W.; Minasian, Stefan G. 分享 收藏
A Perspective on Sustainable Computational Chemistry Software Development and Integration Di Felice, Rosa; Mayes, Maricris L.; Richard, Ryan M.; Williams-Young, David B.; Chan, Garnet Kin-Lic; de Jong, Wibe A.; Govind, Niranjan; Head-Gordon, Martin; Hermes, Matthew R.; Kowalski, Karol; Li, Xiaosong; Lischka, Hans; Mueller, Karl T.; Mutlu, Erdal; Niklasson, Anders M. N.; Pederson, Mark R.; Peng, Bo; Shepard, Ron; Valeev, Edward F.; van Schilfgaarde, Mark; Vlaisavljevich, Bess; Windus, Theresa L.; Xantheas, Sotiris S.; Zhang, Xing; Zimmerman, Paul M. 分享 收藏
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Distributed memory, GPU accelerated Fock construction for hybrid, Gaussian basis density functional theory Williams-Young, David B.; Asadchev, Andrey; Popovici, Doru Thom; Clark, David; Waldrop, Jonathan; Windus, Theresa L.; Valeev, Edward F.; de Jong, Wibe A. 分享 收藏
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PluginPlay: Enabling exascale scientific software one module at a time Richard, Ryan M. M.; Keipert, Kristopher; Waldrop, Jonathan; Keceli, Murat; Williams-Young, David; Bair, Raymond; Boschen, Jeffery; Crandall, Zachery; Gasperich, Kevin; Mahmud, Quazi Ishtiaque; Panyala, Ajay; Valeev, Edward; van Dam, Hubertus; de Jong, Wibe A. A.; Windus, Theresa L. L. 分享 收藏
Quantum Simulation for High-Energy Physics 高能物理的量子模拟 Bauer, Christian W.; Davoudi, Zohreh; Balantekin, A. Baha; Bhattacharya, Tanmoy; Carena, Marcela; de Jong, Wibe A.; Draper, Patrick; El-Khadra, Aida; Gemelke, Nate; Hanada, Masanori; Kharzeev, Dmitri; Lamm, Henry; Li, Ying-Yin; Liu, Junyu; Lukin, Mikhail; Meurice, Yannick; Monroe, Christopher; Nachman, Benjamin; Pagano, Guido; Preskill, John; Rinaldi, Enrico; Roggero, Alessandro; Santiago, David I.; Savage, Martin J.; Siddiqi, Irfan; Siopsis, George; Van Zanten, David; Wiebe, Nathan; Yamauchi, Yukari; Yeter-Aydeniz, Kuebra; Zorzetti, Silvia 分享 收藏
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