Optical absorption line shape by the method of moments

1970 ◽  
Vol 8 (23) ◽  
pp. 2033-2036 ◽  
Author(s):  
R. Sati ◽  
M. Inoue ◽  
S. Wang
Keyword(s):  
Optical Absorption ◽  
Absorption Line ◽  
Method Of Moments ◽  
Line Shape ◽  
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.

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