TurboGenius: Python suite for high-throughput calculations of ab initio quantum Monte Carlo methods.

Autor: Nakano, Kousuke1,2 (AUTHOR) kousuke_1123@icloud.com, Kohulák, Oto1,3 (AUTHOR), Raghav, Abhishek1,4 (AUTHOR), Casula, Michele4 (AUTHOR), Sorella, Sandro1 (AUTHOR)
Zdroj: Journal of Chemical Physics. 12/14/2023, Vol. 159 Issue 22, p1-21. 21p.
Databáze: Academic Search Ultimate