Double-Hybrid Density Functional Theory for Core Excitations: Theory and Benchmark Calculations-Reference-Cited by-同舟云学术

Double-Hybrid Density Functional Theory for Core Excitations: Theory and Benchmark Calculations

Published:2023-02-01 Issue:4 Volume:19 Page:1310-1321
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Mester Dávid¹²³^ORCID,Kállay Mihály¹²³^ORCID

Affiliation:

1. Department of Physical Chemistry and Materials Science, Faculty of Chemical Technology and Biotechnology, Budapest University of Technology and Economics, Müegyetem rkp. 3, H-1111Budapest, Hungary

2. ELKH-BME Quantum Chemistry Research Group, Müegyetem rkp. 3, H-1111Budapest, Hungary

3. MTA-BME Lendület Quantum Chemistry Research Group, Müegyetem rkp. 3, H-1111Budapest, Hungary

Funder

Nemzeti Kutat?si Fejleszt?si ?s Innov?ci?s Hivatal

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.2c01222

Reference111 articles.

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5. Perovskite-related oxynitrides – Recent developments in synthesis, characterisation and investigations of physical properties

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