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Authors
Evgeny Moerman, Felix Hummel, Andreas Grüneis, Andreas Irmler, Matthias Scheffler
Citation
Moerman et al., (2022). Interface to high-performance periodic coupled-cluster theory calculations with atom-centered, localized basis functions. Journal of Open Source Software, 7(74), 4040, https://doi.org/10.21105/joss.04040
@article{Moerman2022,
doi = {10.21105/joss.04040},
url = {https://doi.org/10.21105/joss.04040},
year = {2022},
publisher = {The Open Journal},
volume = {7},
number = {74},
pages = {4040},
author = {Evgeny Moerman and Felix Hummel and Andreas Grüneis and Andreas Irmler and Matthias Scheffler},
title = {Interface to high-performance periodic coupled-cluster theory calculations with atom-centered, localized basis functions},
journal = {Journal of Open Source Software}
}
Tags
Materials science Quantum chemistry High-performance Periodic Coupled Cluster
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