Search research articles
Contact Us
Filters
Showing results (31-40 of 70) with videos related to
Page
of 7
Sort By:
The Journal of Physical Chemistry. A
|
August 24, 2019
Theoretical Study of Cationic Alkali Dimers Interacting with He: Li<sub>2</sub><sup>+</sup>-He and Na<sub>2</sub><sup>+</sup>-He van der Waals Complexes
Nissrin Alharzali, Hamid Berriche, Pablo Villarreal, et al.
The Journal of Chemical Physics
|
January 30, 2021
Computational density-functional approaches on finite-size and guest-lattice effects in CO<sub>2</sub>@sII clathrate hydrate
Adriana Cabrera-Ramírez, Raquel Yanes-Rodríguez, Rita Prosmiti
Journal of Molecular Graphics & Modelling
|
July 16, 2023
Quantum computations in heavy noble-gas hydride cations: Reference energies and new spectroscopic data
María Judit Montes de Oca-Estévez, Rita Prosmiti
Molecules (Basel, Switzerland)
|
September 14, 2024
Microsolvation of a Proton by Ar Atoms: Structures and Energetics of Ar<sub>n</sub>H<sup>+</sup> Clusters
María Judit Montes de Oca-Estévez, Rita Prosmiti
The Journal of Chemical Physics
|
July 21, 2004
Quantum treatment of the Ar-HI photodissociation dynamics
Sergio López-López, Rita Prosmiti, Alberto García-Vela
Physical Chemistry Chemical Physics : PCCP
|
May 19, 2022
Delving into guest-free and He-filled sI and sII clathrate hydrates: a first-principles computational study
Raquel Yanes-Rodríguez, Adriana Cabrera-Ramírez, Rita Prosmiti
The Journal of Chemical Physics
|
July 23, 2004
Potential energy surface and rovibrational states of the ground Ar-HI complex
Rita Prosmiti, Sergio López-López, Alberto García-Vela
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
March 31, 2018
A Systematic Protocol for Benchmarking Guest-Host Interactions by First-Principles Computations: Capturing CO<sub>2</sub> in Clathrate Hydrates
Daniel J Arismendi-Arrieta, Álvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics
|
March 3, 2005
Ab initio calculations, potential representation and vibrational dynamics of He2Br2 van der Waals complex
Alvaro Valdés, Rita Prosmiti, Pablo Villarreal, et al.
Molecules (Basel, Switzerland)
|
March 10, 2022
A Benchmark Protocol for DFT Approaches and Data-Driven Models for Halide-Water Clusters
Raúl Rodríguez-Segundo, Daniel J Arismendi-Arrieta, Rita Prosmiti
Page
of 7
Search research articles
Search
Showing results (31-40 of 70) with videos related to
Sort By:
Page
of 7
The Journal of Physical Chemistry. A
|
August 24, 2019
Theoretical Study of Cationic Alkali Dimers Interacting with He: Li<sub>2</sub><sup>+</sup>-He and Na<sub>2</sub><sup>+</sup>-He van der Waals Complexes
Nissrin Alharzali, Hamid Berriche, Pablo Villarreal, et al.
The Journal of Chemical Physics
|
January 30, 2021
Computational density-functional approaches on finite-size and guest-lattice effects in CO<sub>2</sub>@sII clathrate hydrate
Adriana Cabrera-Ramírez, Raquel Yanes-Rodríguez, Rita Prosmiti
Journal of Molecular Graphics & Modelling
|
July 16, 2023
Quantum computations in heavy noble-gas hydride cations: Reference energies and new spectroscopic data
María Judit Montes de Oca-Estévez, Rita Prosmiti
Molecules (Basel, Switzerland)
|
September 14, 2024
Microsolvation of a Proton by Ar Atoms: Structures and Energetics of Ar<sub>n</sub>H<sup>+</sup> Clusters
María Judit Montes de Oca-Estévez, Rita Prosmiti
The Journal of Chemical Physics
|
July 21, 2004
Quantum treatment of the Ar-HI photodissociation dynamics
Sergio López-López, Rita Prosmiti, Alberto García-Vela
Physical Chemistry Chemical Physics : PCCP
|
May 19, 2022
Delving into guest-free and He-filled sI and sII clathrate hydrates: a first-principles computational study
Raquel Yanes-Rodríguez, Adriana Cabrera-Ramírez, Rita Prosmiti
The Journal of Chemical Physics
|
July 23, 2004
Potential energy surface and rovibrational states of the ground Ar-HI complex
Rita Prosmiti, Sergio López-López, Alberto García-Vela
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
March 31, 2018
A Systematic Protocol for Benchmarking Guest-Host Interactions by First-Principles Computations: Capturing CO<sub>2</sub> in Clathrate Hydrates
Daniel J Arismendi-Arrieta, Álvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics
|
March 3, 2005
Ab initio calculations, potential representation and vibrational dynamics of He2Br2 van der Waals complex
Alvaro Valdés, Rita Prosmiti, Pablo Villarreal, et al.
Molecules (Basel, Switzerland)
|
March 10, 2022
A Benchmark Protocol for DFT Approaches and Data-Driven Models for Halide-Water Clusters
Raúl Rodríguez-Segundo, Daniel J Arismendi-Arrieta, Rita Prosmiti
Page
of 7