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Publication details

Document type
Journal articles

Document subtype
Full paper

Title
Born-Oppenheimer molecular dynamics and electronic properties of liquid H2S: The importance of a non-local approach to dispersion interactions

Participants in the publication
JRS Politi (Author)
JBL Martins (Author)
BJC Cabral (Author)
BioISI - Biosystems & Integrative Sciences Institute
 Dep. Química e Bioquímica
Date of Publication
2022-11

Where published
Journal of Molecular Liquids

Publication Identifiers
ISSN - 0167-7322

Publisher
Elsevier BV

Volume
366

Starting page
120252

Document Identifiers
DOI - https://doi.org/10.1016/j.molliq.2022.120252
URL - https://doi.org/10.1016/j.molliq.2022.120252

Rankings
Web Of Science Q2 (2021) - 6.633 - CHEMISTRY, PHYSICAL - SCIE
SCOPUS Q1 (2021) - 9 - Physical and Theoretical Chemistry
SCIMAGO Q1 (2021) - 914 - Physical and Theoretical Chemistry


Export

APA
JRS Politi, JBL Martins, BJC Cabral, (2022). Born-Oppenheimer molecular dynamics and electronic properties of liquid H2S: The importance of a non-local approach to dispersion interactions. Journal of Molecular Liquids, 366, ISSN 0167-7322. eISSN . https://doi.org/10.1016/j.molliq.2022.120252

IEEE
JRS Politi, JBL Martins, BJC Cabral, "Born-Oppenheimer molecular dynamics and electronic properties of liquid H2S: The importance of a non-local approach to dispersion interactions" in Journal of Molecular Liquids, vol. 366, 2022. 10.1016/j.molliq.2022.120252

BIBTEX
@article{63327, author = {JRS Politi and JBL Martins and BJC Cabral}, title = {Born-Oppenheimer molecular dynamics and electronic properties of liquid H2S: The importance of a non-local approach to dispersion interactions}, journal = {Journal of Molecular Liquids}, year = 2022, volume = 366 }