Velocity-Gauge Real-Time Time-Dependent Density Functional Tight-Binding for Large-Scale Condensed Matter Systems-Reference-Cited by-同舟云学术

Velocity-Gauge Real-Time Time-Dependent Density Functional Tight-Binding for Large-Scale Condensed Matter Systems

Published:2023-11-13 Issue:22 Volume:19 Page:7989-7997
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Xu Qiang¹^ORCID,Del Ben Mauro²,Sait Okyay Mahmut¹,Choi Min¹,Ibrahim Khaled Z.²,Wong Bryan M.¹^ORCID

Affiliation:

1. Materials Science & Engineering Program, Department of Chemistry, and Department of Physics & Astronomy, University of California−Riverside, Riverside, California 92521, United States

2. Applied Mathematics & Computational Research Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States

Funder

Advanced Scientific Computing Research

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c00689

Reference61 articles.

1. Density-Functional Theory for Time-Dependent Systems

2. Causality and Symmetry in Time-Dependent Density-Functional Theory

3. Time-Dependent Density-Functional Theory

4. Time-dependent local-density approximation in real time

5. Time-dependent local-density approximation in real time: Application to conjugated molecules

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