Articles with "complex absorbing" as a keyword



Photo from wikipedia

Decay Processes in Cationic Alkali Metals in Microsolvated Clusters: A Complex Absorbing Potential Based Equation-of-Motion Coupled Cluster Investigation.

Sign Up to like & get
recommendations!
Published in 2022 at "Journal of chemical theory and computation"

DOI: 10.1021/acs.jctc.1c01036

Abstract: We have employed the highly accurate complex absorbing potential based ionization potential equation-of-motion coupled cluster singles and doubles (CAP-IP-EOM-CCSD) method to study the various intermolecular decay processes in ionized metals (Li+, Na+, K+) microsolvated by… read more here.

Keywords: potential based; absorbing potential; decay processes; equation motion ... See more keywords