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1دورية أكاديمية
المؤلفون: 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 MN, 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
المصدر: Journal of Chemical Theory and Computation. 19(20)
مصطلحات موضوعية: Chemical Sciences, Physical Chemistry, Theoretical and Computational Chemistry, Networking and Information Technology R&D (NITRD), CSD-46-All CSGB, Biochemistry and Cell Biology, Computer Software, Chemical Physics, Physical chemistry, Theoretical and computational chemistry
وصف الملف: application/pdf
URL الوصول: https://escholarship.org/uc/item/9s2099r7
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2دورية أكاديمية
المؤلفون: Williams-Young, David B, Asadchev, Andrey, Popovici, Doru Thom, Clark, David, Waldrop, Jonathan, Windus, Theresa L, Valeev, Edward F, de Jong, Wibe A
المصدر: The Journal of Chemical Physics. 158(23)
مصطلحات موضوعية: Engineering, Chemical Sciences, Physical Sciences, Density Functional Theory, Computer Graphics, Algorithms, Chemical Physics, Chemical sciences, Physical sciences
وصف الملف: application/pdf
URL الوصول: https://escholarship.org/uc/item/5h87r4f5
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3دورية أكاديمية
المؤلفون: Richard, Ryan M, Keipert, Kristopher, Waldrop, Jonathan, Keçeli, 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, Windus, Theresa L
المصدر: The Journal of Chemical Physics. 158(18)
مصطلحات موضوعية: Engineering, Chemical Sciences, Physical Sciences, Networking and Information Technology R&D (NITRD), Chemical Physics, Chemical sciences, Physical sciences
وصف الملف: application/pdf
URL الوصول: https://escholarship.org/uc/item/2xh2j8nc
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4تقرير
المؤلفون: Gavini, Vikram, Baroni, Stefano, Blum, Volker, Bowler, David R., Buccheri, Alexander, Chelikowsky, James R., Das, Sambit, Dawson, William, Delugas, Pietro, Dogan, Mehmet, Draxl, Claudia, Galli, Giulia, Genovese, Luigi, Giannozzi, Paolo, Giantomassi, Matteo, Gonze, Xavier, Govoni, Marco, Gulans, Andris, Gygi, François, Herbert, John M., Kokott, Sebastian, Kühne, Thomas D., Liou, Kai-Hsin, Miyazaki, Tsuyoshi, Motamarri, Phani, Nakata, Ayako, Pask, John E., Plessl, Christian, Ratcliff, Laura E., Richard, Ryan M., Rossi, Mariana, Schade, Robert, Scheffler, Matthias, Schütt, Ole, Suryanarayana, Phanish, Torrent, Marc, Truflandier, Lionel, Windus, Theresa L., Xu, Qimen, Yu, Victor W. -Z., Perez, Danny
مصطلحات موضوعية: Condensed Matter - Materials Science, Physics - Computational Physics
URL الوصول: http://arxiv.org/abs/2209.12747
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5دورية أكاديمية
المؤلفون: Williams-Young, David B, Bagusetty, Abhishek, de Jong, Wibe A, Doerfler, Douglas, van Dam, Hubertus JJ, Vázquez-Mayagoitia, Álvaro, Windus, Theresa L, Yang, Chao
مصطلحات موضوعية: Information and Computing Sciences, Applied Computing, Density functional theory, Accelerator, Graphics processing unit, Performance portability, Distributed Computing, Cognitive Sciences, Distributed computing and systems software
وصف الملف: application/pdf
URL الوصول: https://escholarship.org/uc/item/1tv5z93g
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6دورية أكاديمية
المؤلفون: Smith, Daniel GA, Lolinco, Annabelle T, Glick, Zachary L, Lee, Jiyoung, Alenaizan, Asem, Barnes, Taylor A, Borca, Carlos H, Di Remigio, Roberto, Dotson, David L, Ehlert, Sebastian, Heide, Alexander G, Herbst, Michael F, Hermann, Jan, Hicks, Colton B, Horton, Joshua T, Hurtado, Adrian G, Kraus, Peter, Kruse, Holger, Lee, Sebastian JR, Misiewicz, Jonathon P, Naden, Levi N, Ramezanghorbani, Farhad, Scheurer, Maximilian, Schriber, Jeffrey B, Simmonett, Andrew C, Steinmetzer, Johannes, Wagner, Jeffrey R, Ward, Logan, Welborn, Matthew, Altarawy, Doaa, Anwar, Jamshed, Chodera, John D, Dreuw, Andreas, Kulik, Heather J, Liu, Fang, Martínez, Todd J, Matthews, Devin A, Schaefer, Henry F, Šponer, Jiří, Turney, Justin M, Wang, Lee-Ping, De Silva, Nuwan, King, Rollin A, Stanton, John F, Gordon, Mark S, Windus, Theresa L, Sherrill, C David, Burns, Lori A
المصدر: The Journal of Chemical Physics. 155(20)
مصطلحات موضوعية: Networking and Information Technology R&D (NITRD), Physical Sciences, Chemical Sciences, Engineering, Chemical Physics
وصف الملف: application/pdf
URL الوصول: https://escholarship.org/uc/item/4h8041v9
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7دورية أكاديمية
المؤلفون: Ash, Tamalika, Windus, Theresa L.
المصدر: In Journal of Molecular Liquids 1 January 2024 393
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8دورية أكاديمية
المؤلفون: Crandall, Zachery, Windus, Theresa L., Richard, Ryan M.
المصدر: Journal of Chemical Physics; 3/7/2024, Vol. 160 Issue 9, p1-20, 20p
مصطلحات موضوعية: INTEGRATED software, ARCHITECTURAL design, WRITING processes
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9دورية أكاديمية
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10دورية أكاديمية
المؤلفون: Kowalski, Karol, Bair, Raymond, Bauman, Nicholas P, Boschen, Jeffery S, Bylaska, Eric J, Daily, Jeff, de Jong, Wibe A, Dunning, Thom, Govind, Niranjan, Harrison, Robert J, Keçeli, Murat, Keipert, Kristopher, Krishnamoorthy, Sriram, Kumar, Suraj, Mutlu, Erdal, Palmer, Bruce, Panyala, Ajay, Peng, Bo, Richard, Ryan M, Straatsma, TP, Sushko, Peter, Valeev, Edward F, Valiev, Marat, van Dam, Hubertus JJ, Waldrop, Jonathan M, Williams-Young, David B, Yang, Chao, Zalewski, Marcin, Windus, Theresa L
المصدر: Chemical Reviews. 121(8)
مصطلحات موضوعية: Engineering, Chemical Sciences, General Chemistry, Chemical sciences
وصف الملف: application/pdf
URL الوصول: https://escholarship.org/uc/item/4sm897jh