Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package
CollaboratorsGonzalez Espinoza, Cristina
; Zech, Alexander; Wesolowski, Tomasz Adam
Published inThe Journal of chemical physics, vol. 155, no. 8, p. 1-59; 084801
Publication date2021-08-28
First online date2021-08-23
Abstract
Affiliation entities
Funding
- Foundation for the National Institutes of Health [R44GM128480]
- U.S. Department of Defense [W911NF-19-C0048]
- U.S. Department of Energy [DE-SC0011297]
- NIGMS NIH HHS [U01 GM121667]
Citation (ISO format)
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package. In: The Journal of chemical physics, 2021, vol. 155, n° 8, p. 1–59. doi: 10.1063/5.0055522
Main files (1)
Article (Published version)
Identifiers
- PID : unige:180195
- DOI : 10.1063/5.0055522
- PMID : 34470363
- PMCID : PMC9984241
Additional URL for this publicationhttps://pubs.aip.org/jcp/article/155/8/084801/1074802/Software-for-the-frontiers-of-quantum-chemistry-An
Journal ISSN0021-9606
