scholarly journals EXPERIMENTAL STUDY OF TEMPERATURE-DEPENDENCE LAWS OF NON-VOIGT ABSORPTION LINE SHAPE PARAMETERS

2017 ◽  
Author(s):  
Jonas Wilzewski ◽  
Georg Wagner ◽  
Joep Loos ◽  
Manfred Birk
Keyword(s):  
Experimental Study ◽  
Temperature Dependence ◽  
Absorption Line ◽  
Line Shape ◽  
Shape Parameters ◽  
Absorption Line Shape

scholarly journals The modeling of the absorption lineshape for embedded molecules through a polarizable QM/MM approach

2018 ◽  
Vol 17 (5) ◽  
pp. 552-560 ◽  
Author(s):  
Daniele Loco ◽  
Sandro Jurinovich ◽  
Lorenzo Cupellini ◽  
Maximilian F. S. J. Menger ◽  
Benedetta Mennucci
Keyword(s):  
Absorption Line ◽  
Line Shape ◽  
Inhomogeneous Broadening ◽  
Complex Matrices ◽  
Absorption Line Shape

We present a polarizable QM/MM strategy to simulate the absorption line shape of chromophores embedded in complex matrices, including both homogeneous and inhomogeneous broadening.

Sign in / Sign up

Export Citation Format

Share Document