Ultrafast Multi-Dimentional Infrared Vibrational Echo Spectroscopy of Molecular Dynamics on Surfaces and in Bulk Systems

2012 ◽  
Author(s):  
Michael D. Fayer
Keyword(s):  
Molecular Dynamics ◽  
Vibrational Echo

scholarly journals Structural Assignments and Dynamics of the A Substates of MbCO:  Spectrally Resolved Vibrational Echo Experiments and Molecular Dynamics Simulations

2003 ◽  
Vol 107 (1) ◽  
pp. 4-7 ◽  
Author(s):  
Kusai A. Merchant ◽  
W. G. Noid ◽  
David E. Thompson ◽  
Ryo Akiyama ◽  
Roger F. Loring ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Dynamics Simulations ◽  
Spectrally Resolved ◽  
Vibrational Echo

Ultrafast Dynamics of Myoglobin without the Distal Histidine:  Stimulated Vibrational Echo Experiments and Molecular Dynamics Simulations

2005 ◽  
Vol 109 (35) ◽  
pp. 16959-16966 ◽  
Author(s):  
Ilya J. Finkelstein ◽  
Anne Goj ◽  
Brian L. McClain ◽  
Aaron M. Massari ◽  
Kusai A. Merchant ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Ultrafast Dynamics ◽  
Dynamics Simulations ◽  
Vibrational Echo

Water Dynamics:  Vibrational Echo Correlation Spectroscopy and Comparison to Molecular Dynamics Simulations

2004 ◽  
Vol 108 (7) ◽  
pp. 1107-1119 ◽  
Author(s):  
John B. Asbury ◽  
Tobias Steinel ◽  
C. Stromberg ◽  
S. A. Corcelli ◽  
C. P. Lawrence ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Correlation Spectroscopy ◽  
Water Dynamics ◽  
Dynamics Simulations ◽  
Vibrational Echo

scholarly journals Conformational Switching between Protein Substates Studied with 2D IR Vibrational Echo Spectroscopy and Molecular Dynamics Simulations

2010 ◽  
Vol 114 (51) ◽  
pp. 17187-17193 ◽  
Author(s):  
Sayan Bagchi ◽  
Dayton G. Thorpe ◽  
Ian F. Thorpe ◽  
Gregory A. Voth ◽  
M. D. Fayer
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Conformational Switching ◽  
2D Ir ◽  
Dynamics Simulations ◽  
Vibrational Echo

Ultrafast 2D-IR vibrational echo spectroscopy: a probe of molecular dynamics

2007 ◽  
Vol 4 (10) ◽  
pp. 704-718 ◽  
Author(s):  
S Park ◽  
K Kwak ◽  
M D Fayer
Keyword(s):  
Molecular Dynamics ◽  
2D Ir ◽  
Vibrational Echo

Temperature dependence of the ultrafast vibrational echo spectroscopy of OD modes in liquid water from first principles simulations

2019 ◽  
Vol 21 (12) ◽  
pp. 6485-6498 ◽  
Author(s):  
Deepak Ojha ◽  
Amalendu Chandra
Keyword(s):  
Molecular Dynamics ◽  
Temperature Dependence ◽  
Liquid Water ◽  
First Principles ◽  
Spectral Diffusion ◽  
Vibrational Echo ◽  
First Principles Molecular Dynamics

The temperature dependence of the vibrational spectral diffusion of OD modes in liquid water is investigated through calculations of vibrational echo spectral observables from first principles molecular dynamics.

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