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Rita Prosmiti

Showing results (11-20 of 70) with videos related to

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Physical Chemistry Chemical Physics : PCCP|December 22, 2021
Assessment of DFT approaches in noble gas clathrate-like clusters: stability and thermodynamicsRaquel Yanes-Rodríguez, Rita Prosmiti
Physical Chemistry Chemical Physics : PCCP|June 14, 2023
Computational investigations of stable multiple-cage-occupancy He clathrate-like hydrostructuresRaquel Yanes-Rodríguez, Rita Prosmiti
Molecules (Basel, Switzerland)|December 9, 2023
Confining He Atoms in Diverse Ice-Phases: Examining the Stability of He Hydrate Crystals through DFT ApproachesRaquel Yanes-Rodríguez, Rita Prosmiti
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|September 16, 2022
Modeling of Structure H Carbon Dioxide Clathrate Hydrates: Guest-Lattice Energies, Crystal Structure, and Pressure DependenciesAdriana Cabrera-Ramírez, Rita Prosmiti
Physical Chemistry Chemical Physics : PCCP|January 3, 2024
Analysing the stability of He-filled hydrates: how many He atoms fit in the sII crystal?Raquel Yanes-Rodríguez, Rita Prosmiti
The Journal of Physical Chemistry. A|February 3, 2012
An ab initio study of the E 3Πg state of the iodine moleculeApostolos Kalemos, Alvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics|July 27, 2012
Theoretical investigation of the He-I2(E3Πg) ion-pair state: ab initio intermolecular potential and vibrational levelsApostolos Kalemos, Álvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics|March 20, 2012
Quantum-dynamics study of the H5+ cluster: full dimensional benchmark results on its vibrational statesÁlvaro Valdés, Rita Prosmiti, Gerardo Delgado-Barrio
The Journal of Chemical Physics|December 13, 2012
Vibrational dynamics of the H5(+) and its isotopologues from multiconfiguration time-dependent Hartree calculationsÁlvaro Valdés, Rita Prosmiti, Gerardo Delgado-Barrio
Journal of Computational Chemistry|April 4, 2023
Confining CO<sub>2</sub> inside sI clathrate-hydrates: The impact of the CO<sub>2</sub> -water interaction on quantized dynamicsÁlvaro Valdés, Adriana Cabrera-Ramírez, Rita Prosmiti
Pageof 7

Showing results (11-20 of 70) with videos related to

Sort By:
Pageof 7
Physical Chemistry Chemical Physics : PCCP|December 22, 2021
Assessment of DFT approaches in noble gas clathrate-like clusters: stability and thermodynamicsRaquel Yanes-Rodríguez, Rita Prosmiti
Physical Chemistry Chemical Physics : PCCP|June 14, 2023
Computational investigations of stable multiple-cage-occupancy He clathrate-like hydrostructuresRaquel Yanes-Rodríguez, Rita Prosmiti
Molecules (Basel, Switzerland)|December 9, 2023
Confining He Atoms in Diverse Ice-Phases: Examining the Stability of He Hydrate Crystals through DFT ApproachesRaquel Yanes-Rodríguez, Rita Prosmiti
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|September 16, 2022
Modeling of Structure H Carbon Dioxide Clathrate Hydrates: Guest-Lattice Energies, Crystal Structure, and Pressure DependenciesAdriana Cabrera-Ramírez, Rita Prosmiti
Physical Chemistry Chemical Physics : PCCP|January 3, 2024
Analysing the stability of He-filled hydrates: how many He atoms fit in the sII crystal?Raquel Yanes-Rodríguez, Rita Prosmiti
The Journal of Physical Chemistry. A|February 3, 2012
An ab initio study of the E 3Πg state of the iodine moleculeApostolos Kalemos, Alvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics|July 27, 2012
Theoretical investigation of the He-I2(E3Πg) ion-pair state: ab initio intermolecular potential and vibrational levelsApostolos Kalemos, Álvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics|March 20, 2012
Quantum-dynamics study of the H5+ cluster: full dimensional benchmark results on its vibrational statesÁlvaro Valdés, Rita Prosmiti, Gerardo Delgado-Barrio
The Journal of Chemical Physics|December 13, 2012
Vibrational dynamics of the H5(+) and its isotopologues from multiconfiguration time-dependent Hartree calculationsÁlvaro Valdés, Rita Prosmiti, Gerardo Delgado-Barrio
Journal of Computational Chemistry|April 4, 2023
Confining CO<sub>2</sub> inside sI clathrate-hydrates: The impact of the CO<sub>2</sub> -water interaction on quantized dynamicsÁlvaro Valdés, Adriana Cabrera-Ramírez, Rita Prosmiti
Pageof 7