One Million Quantum States of Benzene-Reference-Cited by-同舟云学术

One Million Quantum States of Benzene

Published:2015-10-12 Issue:50 Volume:119 Page:12417-12433
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Halverson Thomas¹,Poirier Bill¹

Affiliation:

1. Department of Chemistry and Biochemistry, and Department of Physics, Texas Tech University, P.O. Box 41061, Lubbock, Texas 79409-1061, United States

Funder

Division of Chemistry

Welch Foundation

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.5b07868

Reference34 articles.

1. Multidimensional Quantum Dynamics

2. Using nonproduct quadrature grids to solve the vibrational Schrödinger equation in 12D

3. Solving the vibrational Schrödinger equation using bases pruned to include strongly coupled functions and compatible quadratures

4. Large scale exact quantum dynamics calculations: Ten thousand quantum states of acetonitrile

5. Calculation of exact vibrational spectra for P2O and CH2NH using a phase space wavelet basis

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