Formulation and Implementation of Frequency-Dependent Linear Response Properties with Relativistic Coupled Cluster Theory for GPU-Accelerated Computer Architectures-Reference-Cited by-同舟云学术

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Formulation and Implementation of Frequency-Dependent Linear Response Properties with Relativistic Coupled Cluster Theory for GPU-Accelerated Computer Architectures

Published:2024-01-09 Issue:2 Volume:20 Page:677-694
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Yuan Xiang¹²^ORCID,Halbert Loïc¹,Pototschnig Johann Valentin²,Papadopoulos Anastasios²,Coriani Sonia³^ORCID,Visscher Lucas²^ORCID,Pereira Gomes André Severo¹^ORCID

Affiliation:

1. Univ. Lille, CNRS, UMR 8523─PhLAM─Physique des Lasers Atomes et Molécules, F-59000 Lille, France

2. Department of Chemistry and Pharmaceutical Sciences, Faculty of Science, Vrije Universiteit Amsterdam, 1081 HV Amsterdam, The Netherlands

3. DTU Chemistry─Department of Chemistry, Technical University of Denmark, DK-2800 Kongens Lyngby, Denmark

Funder

Universit? de Lille

Agence Nationale de la Recherche

Danmarks Frie Forskningsfond

Deutsche Forschungsgemeinschaft

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c00812

Reference162 articles.

1. Molecular vibrational and rotational motion in static and dynamic electric fields

2. Non-Linear Optical Properties of Matter

3. Multi-Photon Absorption of Molecules

4. A review: A new insight for electronic polarizability and chemical bond strength in Bi2O3-based glasses

Cited by 1 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. A reduced cost four-component relativistic unitary coupled cluster method for atoms and molecules;The Journal of Chemical Physics;2024-07-15

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