A semiempirical effective Hamiltonian based approach for analyzing excited state wave functions and computing excited state absorption spectra using real-time dynamics-Reference-Cited by-同舟云学术

A semiempirical effective Hamiltonian based approach for analyzing excited state wave functions and computing excited state absorption spectra using real-time dynamics

Published:2019-03-14 Issue:10 Volume:150 Page:104103
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Ghosh Soumen¹^ORCID,Asher Jason C.¹,Gagliardi Laura¹^ORCID,Cramer Christopher J.¹^ORCID,Govind Niranjan²^ORCID

Affiliation:

1. Department of Chemistry, Chemical Theory Center, and Supercomputing Institute, University of Minnesota, 207 Pleasant Street SE, Minneapolis, Minnesota 55455-0431, USA

2. Environmental Molecular Sciences Laboratory, Pacific Northwest National Laboratory, Richland, Washington 99338, USA

Funder

US department of Energy

US Department of Energy

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.5061746

Reference61 articles.

1. Recent Advances in Wave Function-Based Methods of Molecular-Property Calculations