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1.
Signatures of the Bromine Atom and Open-Shell Spin Coupling in the X-ray Spectrum of the Bromobenzene Cation.
J Am Chem Soc
; 145(6): 3554-3560, 2023 Feb 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-36735829
2.
Interplay of Open-Shell Spin-Coupling and Jahn-Teller Distortion in Benzene Radical Cation Probed by X-ray Spectroscopy.
J Phys Chem A
; 124(46): 9532-9541, 2020 Nov 19.
Artículo
en Inglés
| MEDLINE | ID: mdl-33103904
3.
Table-Top X-ray Spectroscopy of Benzene Radical Cation.
J Phys Chem A
; 124(46): 9524-9531, 2020 Nov 19.
Artículo
en Inglés
| MEDLINE | ID: mdl-33107734
4.
Accurate prediction of core-level spectra of radicals at density functional theory cost via square gradient minimization and recoupling of mixed configurations.
J Chem Phys
; 153(13): 134108, 2020 Oct 07.
Artículo
en Inglés
| MEDLINE | ID: mdl-33032432
5.
Electron-Withdrawing Effects in the Photodissociation of CH2ICl To Form CH2Cl Radical, Simultaneously Viewed Through the Carbon K and Chlorine L2,3 X-ray Edges.
J Am Chem Soc
; 140(41): 13360-13366, 2018 Oct 17.
Artículo
en Inglés
| MEDLINE | ID: mdl-30247894
6.
Photoinduced Heterocyclic Ring Opening of Furfural: Distinct Open-Chain Product Identification by Ultrafast X-ray Transient Absorption Spectroscopy.
J Am Chem Soc
; 140(39): 12538-12544, 2018 10 03.
Artículo
en Inglés
| MEDLINE | ID: mdl-30204442
7.
X-ray transient absorption reveals the 1Au (nπ*) state of pyrazine in electronic relaxation.
Nat Commun
; 12(1): 5003, 2021 08 18.
Artículo
en Inglés
| MEDLINE | ID: mdl-34408141
8.
Tracing the 267 nm-Induced Radical Formation in Dimethyl Disulfide Using Time-Resolved X-ray Absorption Spectroscopy.
J Phys Chem Lett
; 10(6): 1382-1387, 2019 Mar 21.
Artículo
en Inglés
| MEDLINE | ID: mdl-30835480
9.
Investigating the Effects of Basis Set on Metal-Metal and Metal-Ligand Bond Distances in Stable Transition Metal Carbonyls: Performance of Correlation Consistent Basis Sets with 35 Density Functionals.
J Chem Theory Comput
; 9(7): 2930-8, 2013 Jul 09.
Artículo
en Inglés
| MEDLINE | ID: mdl-26583976
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