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TREXIO: A file format and library for quantum chemistry.
J Chem Phys. 2023 May 7;158(17):174801. doi: 10.1063/5.0148161.
J Chem Phys. 2023.
PMID: 37144717
Quantum Monte Carlo for large chemical systems: implementing efficient strategies for petascale platforms and beyond.
Scemama A, Caffarel M, Oseret E, Jalby W.
Scemama A, et al. Among authors: jalby w.
J Comput Chem. 2013 Apr 30;34(11):938-51. doi: 10.1002/jcc.23216. Epub 2013 Jan 3.
J Comput Chem. 2013.
PMID: 23288704
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