ARTICLE
|
doi:10.20944/preprints201808.0166.v1
Subject:
Chemistry And Materials Science,
Physical Chemistry
Keywords:
Ferrocenium conformers, electron structure of organometallic complexes, excess orbital energy spectrum (EOES), α- and β-electrons of Fc+, energy decomposition analysis (EDA).
Online: 8 August 2018 (11:16:59 CEST)
ARTICLE
|
doi:10.20944/preprints202101.0488.v1
Subject:
Chemistry And Materials Science,
Analytical Chemistry
Keywords:
Metal-carbonyl complexes; [FeFe]-hydrogenases; density functional theory; time-dependent DFT; organometallic photochemistry
Online: 25 January 2021 (11:43:03 CET)