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Wirawan Purwanto

William & Mary

12H-index
60Paper Count
1.7KCitation Count
Published Papers 14
Publication Date
Recent developments in the PySCF program package
err2020-07-09
err482
errOAAI
errSun, Qiming; Zhang, Xing; Banerjee, Samragni; Bao, Peng; Barbry, Marc; Blunt, Nick S.; Bogdanov, Nikolay A.; Booth, George H.; Chen, Jia; Cui, Zhi-Hao; Eriksen, Janus Juul; Gao, Yang; Guo, Sheng; Hermann, Jan; Hermes, Matthew R.; Koh, Kevin; Koval, Peter; Lehtola, Susi; Li, Zhendong; Liu, Junzi; Mardirossian, Narbe; McClain, James D.; Motta, Mario; Mussard, Bastien; Pham, Hung Q.; Pulkin, Artem; Purwanto, Wirawan; Robinson, Paul J.; Ronca, Enrico; Sayfutyarova, Elvira; Scheurer, Maximilian; Schurkus, Henry F.; Smith, James E. T.; Sun, Chong; Sun, Shi-Ning; Upadhyay, Shiv; Wagner, Lucas K.; Wang, Xiao; White, Alec; Whitfield, James Daniel; Williamson, Mark J.; Wouters, Sebastian; Yang, Jun; Yu, Jason M.; Zhu, Tianyu; Berkelbach, Timothy C.; Sharma, Sandeep; Sokolov, Alexander; Chan, Garnet Kin-Lic
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Auxiliary-field quantum Monte Carlo calculations of the molybdenum dimer
err2016-06-27
err19
errOAAI
errPurwanto, Wirawan; Zhang, Shiwei; Krakauer, Henry
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An auxiliary-field quantum Monte Carlo study of the chromium dimer
err2015-02-09
err63
errOAAI
errPurwanto, Wirawan; Zhang, Shiwei; Krakauer, Henry
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Ab initio many-body study of cobalt adatoms adsorbed on graphene
err2012-12-28
err28
errOAAI
errVirgus, Yudistira; Purwanto, Wirawan; Krakauer, Henry; Zhang, Shiwei
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Assessing weak hydrogen binding on Ca+ centers: An accurate many-body study with large basis sets
err2011-10-28
err62
errOAAI
errPurwanto, Wirawan; Krakauer, Henry; Virgus, Yudistira; Zhang, Shiwei
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Phaseless auxiliary-field quantum Monte Carlo calculations with plane waves and pseudopotentials: Applications to atoms and molecules
err2007-06-22
err72
PREAI
errSuewattana, Malliga; Purwanto, Wirawan; Zhang, Shiwei; Krakauer, Henry; Walter, Eric J.
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