Basis set incompleteness errors in fixed-node diffusion Monte Carlo calculations on non-covalent interactions

Fuente: arXiv

Saved in:

Bibliographic Details
Main Authors:	Nakano, Kousuke, Shi, Benjamin X., Alfè, Dario, Zen, Andrea
Format:	Preprint
Published:	2024
Subjects:	Chemical Physics Computational Physics
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Internet

https://arxiv.org/abs/2412.00368