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Hydrogen binding on the B36borophene nanoflake decorated with first row transition metal atoms: DFT, QTAIM and AIMD study

Authors :
Tančárová, Kristína
Voroshylova, Iuliia V.
Bucinsky, Lukas
Malček, Michal
Source :
FlatChem; January 2025, Vol. 49 Issue: 1
Publication Year :
2025

Abstract

[Display omitted]

Details

Language :
English
ISSN :
24522627
Volume :
49
Issue :
1
Database :
Supplemental Index
Journal :
FlatChem
Publication Type :
Periodical
Accession number :
ejs68370242
Full Text :
https://doi.org/10.1016/j.flatc.2024.100799