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Journal of Molecular Modeling
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April 3, 2014
Calculation of the two-dimensional non-separable partition function for two molecular systems
Luis Simón-Carballido, Antonio Fernández-Ramos
Physical Chemistry Chemical Physics : PCCP
|
March 11, 2016
Hindered rotor tunneling splittings: an application of the two-dimensional non-separable method to benzyl alcohol and two of its fluorine derivatives
Tiago Vinicius Alves, Luis Simón-Carballido, Fernando Rei Ornellas, et al.
The Journal of Physical Chemistry. B
|
October 21, 2015
Kinetic Isotope Effects in Multipath VTST: Application to a Hydrogen Abstraction Reaction
Luis Simón-Carballido, Tiago Vinicius Alves, Agnieszka Dybala-Defratyka, et al.
Journal of Chemical Theory and Computation
|
July 1, 2017
Anharmonicity of Coupled Torsions: The Extended Two-Dimensional Torsion Method and Its Use To Assess More Approximate Methods
Luis Simón-Carballido, Junwei Lucas Bao, Tiago Vinicius Alves, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 4) with videos related to
Sort By:
Page
of 1
Journal of Molecular Modeling
|
April 3, 2014
Calculation of the two-dimensional non-separable partition function for two molecular systems
Luis Simón-Carballido, Antonio Fernández-Ramos
Physical Chemistry Chemical Physics : PCCP
|
March 11, 2016
Hindered rotor tunneling splittings: an application of the two-dimensional non-separable method to benzyl alcohol and two of its fluorine derivatives
Tiago Vinicius Alves, Luis Simón-Carballido, Fernando Rei Ornellas, et al.
The Journal of Physical Chemistry. B
|
October 21, 2015
Kinetic Isotope Effects in Multipath VTST: Application to a Hydrogen Abstraction Reaction
Luis Simón-Carballido, Tiago Vinicius Alves, Agnieszka Dybala-Defratyka, et al.
Journal of Chemical Theory and Computation
|
July 1, 2017
Anharmonicity of Coupled Torsions: The Extended Two-Dimensional Torsion Method and Its Use To Assess More Approximate Methods
Luis Simón-Carballido, Junwei Lucas Bao, Tiago Vinicius Alves, et al.
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of 1