{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,1,24]],"date-time":"2026-01-24T14:27:30Z","timestamp":1769264850536,"version":"3.49.0"},"publisher-location":"New York, NY, USA","reference-count":47,"publisher":"ACM","license":[{"start":{"date-parts":[[2019,11,17]],"date-time":"2019-11-17T00:00:00Z","timestamp":1573948800000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/www.acm.org\/publications\/policies\/copyright_policy#Background"}],"funder":[{"DOI":"10.13039\/100000015","name":"U.S. Department of Energy","doi-asserted-by":"publisher","award":["DE-SC0017867,KC2301,DEAC02-05CH11231"],"award-info":[{"award-number":["DE-SC0017867,KC2301,DEAC02-05CH11231"]}],"id":[{"id":"10.13039\/100000015","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["DMS-1652330,1450372"],"award-info":[{"award-number":["DMS-1652330,1450372"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["dl.acm.org"],"crossmark-restriction":true},"short-container-title":[],"published-print":{"date-parts":[[2019,11,17]]},"DOI":"10.1145\/3295500.3356144","type":"proceedings-article","created":{"date-parts":[[2019,11,7]],"date-time":"2019-11-07T19:43:22Z","timestamp":1573155802000},"page":"1-23","update-policy":"https:\/\/doi.org\/10.1145\/crossmark-policy","source":"Crossref","is-referenced-by-count":11,"title":["Parallel transport time-dependent density functional theory calculations with hybrid functional on summit"],"prefix":"10.1145","author":[{"given":"Weile","family":"Jia","sequence":"first","affiliation":[{"name":"University of California"}]},{"given":"Lin-Wang","family":"Wang","sequence":"additional","affiliation":[{"name":"Lawrence Berkeley National Laboratory"}]},{"given":"Lin","family":"Lin","sequence":"additional","affiliation":[{"name":"University of California"}]}],"member":"320","published-online":{"date-parts":[[2019,11,17]]},"reference":[{"key":"e_1_3_2_1_1_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.progsurf.2017.09.002"},{"key":"e_1_3_2_1_2_1","unstructured":"D. An and L. Lin. [n. d.]. Quantum dynamics with the parallel transport gauge. arXiv:1804.02095 ([n. d.]).  D. An and L. Lin. [n. d.]. Quantum dynamics with the parallel transport gauge. arXiv:1804.02095 ([n. d.])."},{"key":"e_1_3_2_1_3_1","doi-asserted-by":"publisher","DOI":"10.1145\/321296.321305"},{"key":"e_1_3_2_1_4_1","doi-asserted-by":"publisher","DOI":"10.1088\/0953-8984\/24\/23\/233202"},{"key":"e_1_3_2_1_5_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.464913"},{"key":"e_1_3_2_1_6_1","doi-asserted-by":"crossref","unstructured":"I. Carnimeo S. Baroni and P. Giannozzi. 2018. Fast hybrid density-functional computations using plane-wave basis sets. Electronic Structure (2018).  I. Carnimeo S. Baroni and P. Giannozzi. 2018. Fast hybrid density-functional computations using plane-wave basis sets. Electronic Structure (2018).","DOI":"10.1088\/2516-1075\/aaf7d4"},{"key":"e_1_3_2_1_7_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41566-017-0059-2"},{"key":"e_1_3_2_1_8_1","doi-asserted-by":"publisher","DOI":"10.1021\/ct500985f"},{"key":"e_1_3_2_1_9_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.5b00826"},{"key":"e_1_3_2_1_10_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2009.12.021"},{"key":"e_1_3_2_1_11_1","doi-asserted-by":"publisher","DOI":"10.1109\/SC.2016.88"},{"key":"e_1_3_2_1_12_1","volume-title":"Angel Rubio, and Alberto Castro.","author":"Pueyo Adri\u00e1n G\u00f3mez","year":"2018","unstructured":"Adri\u00e1n G\u00f3mez Pueyo , Miguel AL Marques , Angel Rubio, and Alberto Castro. 2018 . Propagators for the time-dependent Kohn-Sham equations: multistep, Runge-Kutta, exponential Runge-Kutta, and commutator free Magnus methods. J. Chem. Theory. Comput . (2018). Adri\u00e1n G\u00f3mez Pueyo, Miguel AL Marques, Angel Rubio, and Alberto Castro. 2018. Propagators for the time-dependent Kohn-Sham equations: multistep, Runge-Kutta, exponential Runge-Kutta, and commutator free Magnus methods. J. Chem. Theory. Comput. (2018)."},{"key":"e_1_3_2_1_13_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2016.04.003"},{"key":"e_1_3_2_1_14_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.23096"},{"key":"e_1_3_2_1_15_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.88.085117"},{"key":"e_1_3_2_1_16_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.1564060"},{"key":"e_1_3_2_1_17_1","article-title":"Erratum: \"Hybrid functionals based on a screened Coulomb potential","volume":"118","author":"Heyd J.","year":"2006","unstructured":"J. Heyd , G. E. Scuseria , and M. Ernzerhof . 2006 . Erratum: \"Hybrid functionals based on a screened Coulomb potential \" [J. Chem. Phys. 118 , 8207 (2003)]. J. Chem. Phys. 124, 21 (2006), 219906. J. Heyd, G. E. Scuseria, and M. Ernzerhof. 2006. Erratum: \"Hybrid functionals based on a screened Coulomb potential\" [J. Chem. Phys. 118, 8207 (2003)]. J. Chem. Phys. 124, 21 (2006), 219906.","journal-title":"[J. Chem. Phys."},{"key":"e_1_3_2_1_18_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.4931732"},{"key":"e_1_3_2_1_19_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.7b00807"},{"key":"e_1_3_2_1_20_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2012.02.017"},{"key":"e_1_3_2_1_21_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.8b00580"},{"key":"e_1_3_2_1_22_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2012.08.002"},{"key":"e_1_3_2_1_23_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jcp.2013.05.005"},{"key":"e_1_3_2_1_24_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2019.02.009"},{"key":"e_1_3_2_1_25_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.softx.2017.11.002"},{"key":"e_1_3_2_1_26_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.6b00092"},{"key":"e_1_3_2_1_27_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jcp.2011.11.032"},{"key":"e_1_3_2_1_28_1","doi-asserted-by":"publisher","DOI":"10.1126\/science.aag1268"},{"key":"e_1_3_2_1_29_1","volume-title":"Soft x-ray excitonics. Science 357, 6356","author":"Moulet Antoine","year":"2017","unstructured":"Antoine Moulet , Julien B Bertrand , Till Klostermann , Alexander Guggenmos , Nicholas Karpowicz , and Eleftherios Goulielmakis . 2017. Soft x-ray excitonics. Science 357, 6356 ( 2017 ), 1134--1138. Antoine Moulet, Julien B Bertrand, Till Klostermann, Alexander Guggenmos, Nicholas Karpowicz, and Eleftherios Goulielmakis. 2017. Soft x-ray excitonics. Science 357, 6356 (2017), 1134--1138."},{"key":"e_1_3_2_1_30_1","unstructured":"NVIDIA. [n. d.]. CUDA 8 Performance Overview. ([n. d.]). http:\/\/developer.download.nvidia.com\/compute\/cuda\/compute-docs\/cuda-performance-report.pdf  NVIDIA. [n. d.]. CUDA 8 Performance Overview. ([n. d.]). http:\/\/developer.download.nvidia.com\/compute\/cuda\/compute-docs\/cuda-performance-report.pdf"},{"key":"e_1_3_2_1_31_1","doi-asserted-by":"publisher","DOI":"10.1103\/RevModPhys.74.601"},{"key":"e_1_3_2_1_32_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.472933"},{"key":"e_1_3_2_1_33_1","doi-asserted-by":"publisher","DOI":"10.1088\/1361-648x\/aaa8c9"},{"key":"e_1_3_2_1_34_1","volume-title":"A Performance Study of Quantum ESPRESSO's PWscf Code on Multi-core and GPU Systems","author":"Romero Joshua","unstructured":"Joshua Romero , Everett Phillips , Gregory Ruetsch , Massimiliano Fatica , Filippo Spiga , and Paolo Giannozzi . 2018. A Performance Study of Quantum ESPRESSO's PWscf Code on Multi-core and GPU Systems . In High Performance Computing Systems. Performance Modeling, Benchmarking, and Simulation, Stephen Jarvis, Steven Wright, and Simon Hammond (Eds.). Springer International Publishing , Cham , 67--87. Joshua Romero, Everett Phillips, Gregory Ruetsch, Massimiliano Fatica, Filippo Spiga, and Paolo Giannozzi. 2018. A Performance Study of Quantum ESPRESSO's PWscf Code on Multi-core and GPU Systems. In High Performance Computing Systems. Performance Modeling, Benchmarking, and Simulation, Stephen Jarvis, Steven Wright, and Simon Hammond (Eds.). Springer International Publishing, Cham, 67--87."},{"key":"e_1_3_2_1_35_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.52.997"},{"key":"e_1_3_2_1_36_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.4937379"},{"key":"e_1_3_2_1_37_1","volume-title":"Attosecond optical-field-enhanced carrier injection into the GaAs conduction band. Nature Physics","author":"Schlaepfer Fabian","year":"2018","unstructured":"Fabian Schlaepfer , Matteo Lucchini , Shunsuke A Sato , Mikhail Volkov , Lamia Kasmi , Nadja Hartmann , Angel Rubio , Lukas Gallmann , and Ursula Keller . 2018. Attosecond optical-field-enhanced carrier injection into the GaAs conduction band. Nature Physics ( 2018 ), 1. Fabian Schlaepfer, Matteo Lucchini, Shunsuke A Sato, Mikhail Volkov, Lamia Kasmi, Nadja Hartmann, Angel Rubio, Lukas Gallmann, and Ursula Keller. 2018. Attosecond optical-field-enhanced carrier injection into the GaAs conduction band. Nature Physics (2018), 1."},{"key":"e_1_3_2_1_38_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2015.05.011"},{"key":"e_1_3_2_1_39_1","doi-asserted-by":"crossref","unstructured":"Martin Schultze Krupa Ramasesha CD Pemmaraju SA Sato D Whitmore A Gandman James S Prell LJ Borja D Prendergast K Yabana etal 2014. Attosecond band-gap dynamics in silicon. Science 346 6215 (2014) 1348--1352.  Martin Schultze Krupa Ramasesha CD Pemmaraju SA Sato D Whitmore A Gandman James S Prell LJ Borja D Prendergast K Yabana et al. 2014. Attosecond band-gap dynamics in silicon. Science 346 6215 (2014) 1348--1352.","DOI":"10.1126\/science.1260311"},{"key":"e_1_3_2_1_40_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41566-017-0049-4"},{"key":"e_1_3_2_1_41_1","doi-asserted-by":"crossref","unstructured":"C. A. Ullrich. 2011. Time-dependent density-functional theory: concepts and applications. Oxford Univ. Pr.  C. A. Ullrich. 2011. Time-dependent density-functional theory: concepts and applications. Oxford Univ. Pr.","DOI":"10.1093\/acprof:oso\/9780199563029.001.0001"},{"key":"e_1_3_2_1_42_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2010.04.018"},{"key":"e_1_3_2_1_43_1","doi-asserted-by":"publisher","DOI":"10.1145\/2063384.2063479"},{"key":"e_1_3_2_1_44_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.64.201107"},{"key":"e_1_3_2_1_45_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.79.085102"},{"key":"e_1_3_2_1_46_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.54.4484"},{"key":"e_1_3_2_1_47_1","volume-title":"James S Prell, David Prendergast, et al.","author":"Z\u00fcrch Michael","year":"2017","unstructured":"Michael Z\u00fcrch , Hung-Tzu Chang , Lauren J Borja , Peter M Kraus , Scott K Cushing , Andrey Gandman , Christopher J Kaplan , Myoung Hwan Oh , James S Prell, David Prendergast, et al. 2017 . Direct and simultaneous observation of ultrafast electron and hole dynamics in germanium. Nature communications 8 (2017), 15734. Michael Z\u00fcrch, Hung-Tzu Chang, Lauren J Borja, Peter M Kraus, Scott K Cushing, Andrey Gandman, Christopher J Kaplan, Myoung Hwan Oh, James S Prell, David Prendergast, et al. 2017. Direct and simultaneous observation of ultrafast electron and hole dynamics in germanium. Nature communications 8 (2017), 15734."}],"event":{"name":"SC '19: The International Conference for High Performance Computing, Networking, Storage, and Analysis","location":"Denver Colorado","acronym":"SC '19","sponsor":["SIGHPC ACM Special Interest Group on High Performance Computing, Special Interest Group on High Performance Computing","IEEE CS"]},"container-title":["Proceedings of the International Conference for High Performance Computing, Networking, Storage and Analysis"],"original-title":[],"link":[{"URL":"https:\/\/dl.acm.org\/doi\/10.1145\/3295500.3356144","content-type":"unspecified","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/dl.acm.org\/doi\/pdf\/10.1145\/3295500.3356144","content-type":"application\/pdf","content-version":"vor","intended-application":"syndication"},{"URL":"https:\/\/dl.acm.org\/doi\/pdf\/10.1145\/3295500.3356144","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2025,6,18]],"date-time":"2025-06-18T01:02:13Z","timestamp":1750208533000},"score":1,"resource":{"primary":{"URL":"https:\/\/dl.acm.org\/doi\/10.1145\/3295500.3356144"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2019,11,17]]},"references-count":47,"alternative-id":["10.1145\/3295500.3356144","10.1145\/3295500"],"URL":"https:\/\/doi.org\/10.1145\/3295500.3356144","relation":{},"subject":[],"published":{"date-parts":[[2019,11,17]]},"assertion":[{"value":"2019-11-17","order":2,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}