Theoretical study on structural properties and hydrogen adsorption performance of C3N doped with monoatomic Al/Li - ScienceDirect
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Adsorption and dissociation behavior of H 2 on PuH 2 (100), (110) and (111) surfaces: a density functional theory+U study - RSC Advances (RSC Publishing) DOI:10.1039/D0RA01621G
Density functional theory calculations for Pd adsorption on SO4 adsorbed on h-BN - ScienceDirect
The adsorption energy (eV) of H 2 , bond length d H-H (Å), adatom to H
Density Functional Theory Studies of the Interaction of H, S, Ni−H, and Ni−S Complexes with the MoS2 Basal Plane
Color online Optimized geometries of Ti C 8 H 8 H 2 n n =1-3 along with
The adsorption energies E ads , H-H bond length and the storage
The adsorption energy (eV) of H 2 , bond length d H-H (Å), adatom to H
Oxidation, Stability, and Magnetic Ground States of Two-Dimensional Layered Electrides
