scholarly journals Quantum Algorithm for the Direct Calculations of Vertical Ionization Energies

2021 ◽  
pp. 2880-2885
Author(s):  
Kenji Sugisaki ◽  
Kazuo Toyota ◽  
Kazunobu Sato ◽  
Daisuke Shiomi ◽  
Takeji Takui
Keyword(s):  
Quantum Algorithm ◽  
Ionization Energies ◽  
Vertical Ionization Energies ◽  
Direct Calculations

A Simple Correlation of Anodic Peak Potentials of Silylarenes and Their Vertical Ionization Energies

2004 ◽  
Vol 23 (7) ◽  
pp. 1636-1638 ◽  
Author(s):  
Anand Dhiman ◽  
James Y. Becker ◽  
Oliver Minge ◽  
Hubert Schmidbaur ◽  
Thomas Müller
Keyword(s):  
Anodic Peak ◽  
Simple Correlation ◽  
Ionization Energies ◽  
Vertical Ionization Energies

Assignment of photoelectron spectra of silatranes: first ionization energies and the nature of the dative Si←N contact

2015 ◽  
Vol 17 (39) ◽  
pp. 26225-26237 ◽  
Author(s):  
Valery F. Sidorkin ◽  
Elena F. Belogolova ◽  
Evgeniya P. Doronina
Keyword(s):  
Photoelectron Spectra ◽  
Ionization Energies ◽  
Vertical Ionization Energies

The problematic experimental (8–12 eV) photoelectron spectra of silatranes were theoretically studied and the correlation was found between the first vertical ionization energies, VIEs1, and the various characteristics of the coordination Si←N contact.

Vertical Ionization Energies of Adenine and 9-Methyl Adenine†

2009 ◽  
Vol 113 (52) ◽  
pp. 14630-14635 ◽  
Author(s):  
O. Dolgounitcheva ◽  
V. G. Zakrzewski ◽  
J. V. Ortiz
Keyword(s):  
Ionization Energies ◽  
Vertical Ionization Energies

DNA Lesion Can Facilitate Base Ionization: Vertical Ionization Energies of Aqueous 8-Oxoguanine and its Nucleoside and Nucleotide

2014 ◽  
Vol 118 (48) ◽  
pp. 13833-13837 ◽  
Author(s):  
Vladimír Palivec ◽  
Eva Pluhařová ◽  
Isaak Unger ◽  
Bernd Winter ◽  
Pavel Jungwirth
Keyword(s):  
Ionization Energies ◽  
Dna Lesion ◽  
Vertical Ionization Energies

Vertical ionization energies of cubane

1994 ◽  
Vol 230 (3) ◽  
pp. 313-316 ◽  
Author(s):  
V.G. Zakrzewski ◽  
J.V. Ortiz
Keyword(s):  
Ionization Energies ◽  
Vertical Ionization Energies
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