Geometry of Fe(CO)5 (xyz coordinates); Excited states: Spin and dipole allowed transitions; Spin allowed, dipole forbidden transitions; Singlet-triplet transitions.The supplementary information for: Allan, M., Lacko, M., Papp, P., Matejcik, S., Zlatar, M., Fabrikant, I. I., Kocisek, J.,& Fedor, J. (2018). Dissociative electron attachment and electronic excitation in Fe(CO)(5). Physical Chemistry Chemical Physics, Royal Soc Chemistry, Cambridge., 20(17), 11692-11701. [https://doi.org/10.1039/c8cp01387j]The published version of the article: [https://cer.ihtm.bg.ac.rs/handle/123456789/2312]The peer-reviewed version of the article: [http://cer.ihtm.bg.ac.rs/handle/123456789/2659
C46H46Au2F2N2O2P2S2, triclinic, P1̄ (no. 2), a = 8.2496(3) Å, b = 11.4366(4) Å, c = 12.9504(4) Å, α ...
C28H20N6O2S2, triclinic, P1̅ (no. 2), a = 10.6738(6) Å, b = 11.7869(7) Å, c = 12.5381(7) Å, α = 112....
We report the syntheses and structural diversity of three different bis-iminopyrrole ligands and the...
In a combined experimental and theoretical study we characterize dissociative electron attachment (...
Computational studies have shown that one or more positrons can stabilize two repelling atomic anion...
We have recorded high-resolution (FWHM = 0.2\,\AA) extreme-ultraviolet (EUV, 800--1350\,\AA) laborat...
We have tested several DFT protocols, at the non-relativistic and relativistic ZORA (scalar and spin...
C32H48BF4FeP2Rh, orthorhombic, P212121 (no. 19), a = 10.640(2) Å, b = 16.007(3) Å, c = 19.460(4) Å, ...
C44H42Au2F2N2O2P2S2, triclinic, P1̄ (no. 2), a = 8.8035(2) Å, b = 11.4764(3) Å, c = 21.2293(6) Å, α ...
C51H43Au2Cl3F2FeN2O2P2S2, triclinic, P1̄ (no. 2), a = 8.3276(1) Å, b = 13.1116(1) Å, c = 13.5547(1) ...
Thermodynamic and kinetic parameters for the oxidative addition of H_2 to [Rh^I(bpy)_2]^+ (bpy = 2,2...
The question of whether hydrogen atom transfer (HAT) or electron transfer (ET) is the key step in th...
C50H55BF4NO2P2Rh, monoclinic, P1211 (no. 4), a = 12.722(3) Å, b = 15.248(3) Å, c = 12.818(3) Å, β = ...
Supplementary material for: [https://doi.org/10.1002/chem.201901845]Related to published version: [h...
Supporting information for: [https://doi.org/10.1021/acs.organomet.5b00041]Related to published vers...
C46H46Au2F2N2O2P2S2, triclinic, P1̄ (no. 2), a = 8.2496(3) Å, b = 11.4366(4) Å, c = 12.9504(4) Å, α ...
C28H20N6O2S2, triclinic, P1̅ (no. 2), a = 10.6738(6) Å, b = 11.7869(7) Å, c = 12.5381(7) Å, α = 112....
We report the syntheses and structural diversity of three different bis-iminopyrrole ligands and the...
In a combined experimental and theoretical study we characterize dissociative electron attachment (...
Computational studies have shown that one or more positrons can stabilize two repelling atomic anion...
We have recorded high-resolution (FWHM = 0.2\,\AA) extreme-ultraviolet (EUV, 800--1350\,\AA) laborat...
We have tested several DFT protocols, at the non-relativistic and relativistic ZORA (scalar and spin...
C32H48BF4FeP2Rh, orthorhombic, P212121 (no. 19), a = 10.640(2) Å, b = 16.007(3) Å, c = 19.460(4) Å, ...
C44H42Au2F2N2O2P2S2, triclinic, P1̄ (no. 2), a = 8.8035(2) Å, b = 11.4764(3) Å, c = 21.2293(6) Å, α ...
C51H43Au2Cl3F2FeN2O2P2S2, triclinic, P1̄ (no. 2), a = 8.3276(1) Å, b = 13.1116(1) Å, c = 13.5547(1) ...
Thermodynamic and kinetic parameters for the oxidative addition of H_2 to [Rh^I(bpy)_2]^+ (bpy = 2,2...
The question of whether hydrogen atom transfer (HAT) or electron transfer (ET) is the key step in th...
C50H55BF4NO2P2Rh, monoclinic, P1211 (no. 4), a = 12.722(3) Å, b = 15.248(3) Å, c = 12.818(3) Å, β = ...
Supplementary material for: [https://doi.org/10.1002/chem.201901845]Related to published version: [h...
Supporting information for: [https://doi.org/10.1021/acs.organomet.5b00041]Related to published vers...
C46H46Au2F2N2O2P2S2, triclinic, P1̄ (no. 2), a = 8.2496(3) Å, b = 11.4366(4) Å, c = 12.9504(4) Å, α ...
C28H20N6O2S2, triclinic, P1̅ (no. 2), a = 10.6738(6) Å, b = 11.7869(7) Å, c = 12.5381(7) Å, α = 112....
We report the syntheses and structural diversity of three different bis-iminopyrrole ligands and the...