Which density functional is close to CCSD accuracy to describe geometry and interaction energy of small non-covalent dimers? A benchmark study using gaussian09 | NIIST

Which density functional is close to CCSD accuracy to describe geometry and interaction energy of small non-covalent dimers? A benchmark study using gaussian09

Year : 2013 Author : Remya, K; Suresh, CH
Research Area :Chemical Sciences and Technology Journal : JOURNAL OF COMPUTATIONAL CHEMISTRY
DOI :10.1002/jcc.23263
Publication Date :04/04/2023 - 11:04