Projected CAP/SAC-CI method with smooth Voronoi potential for calculating resonance states-Reference-Cited by-同舟云学术

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Projected CAP/SAC-CI method with smooth Voronoi potential for calculating resonance states

Published:2015-07-21 Issue:2 Volume:37 Page:242-249
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Ehara Masahiro¹²,Fukuda Ryoichi¹²,Sommerfeld Thomas³

Affiliation:

1. Institute for Molecular Science and Research Center for Computational Science; 38 Nishigonaka, Myodaiji Okazaki 444-8585 Japan

2. Elements Strategy Initiative for Catalysts and Batteries (ESICB); Kyoto University; Katsura Kyoto 615-8520 Japan

3. Department of Chemistry and Physics; Southeastern Louisiana University; SLU 10878 Hammond Louisiana 70402

Funder

Japan Society for the Promotion of Science

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/jcc.24010/fullpdf

Reference54 articles.

1. Temporary anion states of polyatomic hydrocarbons

2. Lifetimes of Metastable Dianions: CN22-, C42-, and CO32-

3. Intermolecular Coulombic decay of clusters

4. Electron-induced chemistry: A forward look

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1. Complex potential energy surfaces with projected CAP technique: Vibrational excitation of N2;The Journal of Chemical Physics;2024-07-10

2. Spectroscopic signatures of states in the continuum characterized by a joint experimental and theoretical study of pyrrole;The Journal of Chemical Physics;2022-11-28

3. Recent Advances in the Study of Negative‐Ion Resonances Using Multiconfigurational Propagator and a Complex Absorbing Potential;ChemPhysChem;2022-11-16

4. Investigation of negative-ion resonances using a subspace-projected multiconfigurational electron propagator perturbed with a complex absorbing potential;The Journal of Chemical Physics;2022-06-14

5. Projected CAP-EOM-CCSD method for electronic resonances;The Journal of Chemical Physics;2022-03-07

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