An ab Initio Linear Response Method for Computing Magnetic Circular Dichroism Spectra with Nonperturbative Treatment of Magnetic Field

2019 ◽  
Vol 15 (5) ◽  
pp. 3162-3169 ◽  
Author(s):  
Shichao Sun ◽  
David Williams-Young ◽  
Xiaosong Li
Keyword(s):  
Magnetic Field ◽  
Circular Dichroism ◽  
Ab Initio ◽  
Linear Response ◽  
Magnetic Circular Dichroism ◽  
Circular Dichroism Spectra ◽  
Response Method ◽  
Circular Dichroïsm ◽  
Magnetic Circular Dichroism Spectra

scholarly journals Natural and magnetic circular dichroism spectra of nucleosides: effect of the dynamics and environment

RSC Advances ◽  
2021 ◽  
Vol 11 (14) ◽  
pp. 8411-8419
Author(s):  
Jakub Kaminský ◽  
Valery Andrushchenko ◽  
Petr Bouř
Keyword(s):  
Molecular Dynamics ◽  
Circular Dichroism ◽  
Nucleic Acids ◽  
Electronic Absorption ◽  
Magnetic Circular Dichroism ◽  
Circular Dichroism Spectra ◽  
Circular Dichroïsm ◽  
Magnetic Circular Dichroism Spectra

Electronic absorption, natural and magnetic circular dichroism spectra of several nucleosides are simulated to understand their dependence on molecular dynamics and environment, their sensitivity to nucleoside pairing and stacking in nucleic acids.

Magnetic circular dichroism studies. 59. Substituent-induced sign variation in the magnetic circular dichroism spectra of chlorins

1981 ◽  
Vol 103 (11) ◽  
pp. 3201-3203 ◽  
Author(s):  
Joseph D. Keegan ◽  
Alan M. Stolzenberg ◽  
Yu-Cheng Lu ◽  
Robert E. Linder ◽  
Guenter Barth ◽  
...  
Keyword(s):  
Circular Dichroism ◽  
Magnetic Circular Dichroism ◽  
Circular Dichroism Spectra ◽  
Circular Dichroïsm ◽  
Magnetic Circular Dichroism Spectra
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