scholarly journals Dynamics of electronically excited states in the eumelanin building block 5,6-dihydroxyindole

2019 ◽  
Vol 21 (15) ◽  
pp. 8152-8160 ◽  
Author(s):  
Stuart W. Crane ◽  
Omair Ghafur ◽  
Thomas Y. Cowie ◽  
Anita G. Lindsay ◽  
James O. F. Thompson ◽  
...  
Keyword(s):  
Gas Phase ◽  
Excited States ◽  
Thermal Desorption ◽  
Building Block ◽  
Electronically Excited States ◽  
Ultraviolet Excitation ◽  
Phase Study ◽  
Electronically Excited ◽  
Adiabatic Dynamics

Laser-based thermal desorption facilitates the first gas-phase study of ultrafast non-adiabatic dynamics operating in 5,6-dihydroxyinole following ultraviolet excitation.

High-Fidelity First Principles Nonadiabaticity: Diabatization, Analytic Representation of Global Diabatic Potential Energy Matrices, and Quantum Dynamics

2021 ◽  
Author(s):  
Yafu Guan ◽  
Changjian Xie ◽  
David R. Yarkony ◽  
Hua Guo
Keyword(s):  
Potential Energy ◽  
Excited States ◽  
First Principles ◽  
Quantum Dynamics ◽  
Chemical Processes ◽  
High Fidelity ◽  
Nonadiabatic Dynamics ◽  
Electronically Excited States ◽  
Electronically Excited ◽  
Oppenheimer Approximation

Nonadiabatic dynamics, which goes beyond the Born-Oppenheimer approximation, has increasingly been shown to play an important role in chemical processes, particularly those involving electronically excited states. Understanding multistate dynamics requires...

Reactions of carbamides in electronically excited states

1978 ◽  
Vol 21 (11) ◽  
pp. 1513-1514
Author(s):  
Yu. A. Tishchenko ◽  
L. V. Orlovskaya ◽  
V. I. Danilova
Keyword(s):  
Excited States ◽  
Electronically Excited States ◽  
Electronically Excited
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