Search

Categories

Theoretical and Computational Chemistry

(2)

Content Types

Review

(1)

Working Paper

(1)

Keywords

local natural orbital method

Authors

2 results in Keywords: local natural orbital method

Theoretical and Computational Chemistry

Basis-set limit CCSD(T) energies for large molecules with local natural orbitals and reduced-scaling basis-set corrections

David Mester, Peter Nagy, Mihaly Kallay

Version 1 posted 22 August 2024

33

Downloads

Theoretical and Computational Chemistry

State-of-the-art local correlation methods enable affordable gold standard quantum chemistry for up to hundreds of atoms

Version 1 posted 12 August 2024

69

Downloads