Isotope effects in liquid water by infrared spectroscopy. II. Factor analysis of the temperature effect on H2O and D2O

2008 ◽  
Vol 129 (6) ◽  
pp. 064503 ◽  
Author(s):  
Pascal Larouche ◽  
Jean-Joseph Max ◽  
Camille Chapados
Keyword(s):  
Factor Analysis ◽  
Infrared Spectroscopy ◽  
Temperature Effect ◽  
Liquid Water ◽  
Isotope Effects

Isotope effects in liquid water by infrared spectroscopy

2002 ◽  
Vol 116 (11) ◽  
pp. 4626-4642 ◽  
Author(s):  
Jean-Joseph Max ◽  
Camille Chapados
Keyword(s):  
Infrared Spectroscopy ◽  
Liquid Water ◽  
Isotope Effects

Temperature, pressure, and isotope effects on the structure and properties of liquid water: A lattice approach

2007 ◽  
Vol 127 (22) ◽  
pp. 224106 ◽  
Author(s):  
Ilhem F. Hakem ◽  
Abdelhak Boussaid ◽  
Hafida Benchouk-Taleb ◽  
Michael R. Bockstaller
Keyword(s):  
Liquid Water ◽  
Isotope Effects ◽  
Structure And Properties ◽  
Lattice Approach

Reactive mode composition factor analysis of transition states: the case of coupled electron–proton transfers

2019 ◽  
Vol 21 (45) ◽  
pp. 24912-24918 ◽  
Author(s):  
Mauricio Maldonado-Domínguez ◽  
Daniel Bím ◽  
Radek Fučík ◽  
Roman Čurík ◽  
Martin Srnec
Keyword(s):  
Factor Analysis ◽  
Kinetic Energy ◽  
Isotope Effects ◽  
Transition States ◽  
Kinetic Isotope Effects ◽  
Composition Factor ◽  
Kinetic Isotope ◽  
Proton Transfers ◽  
Relative Kinetic ◽  
Reactive Mode

The kinetic energy distribution in the reactive mode in transition states correlates the asynchronicity of CPET with relative kinetic isotope effects.

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