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The Journal of Physical Chemistry. A
|
March 30, 2013
Quantum mechanical characterization of the He4ICl weakly bound complex
Álvaro Valdés, Rita Prosmiti
The Journal of Physical Chemistry. A
|
February 9, 2013
Theoretical investigation of the infrared spectra of the H5(+) and D5(+) cations
Álvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics
|
May 10, 2024
CO2 inside sI clathrate-like cages: Automated construction of neural network/machine learned guest-host potential and quantum spectra computations
Álvaro Valdés, Rita Prosmiti
Philosophical Transactions. Series A, Mathematical, Physical, and Engineering Sciences
|
August 6, 2019
The smallest proton-bound dimer H<sub>5</sub><sup>+</sup>: theoretical progress
Rita Prosmiti, Álvaro Valdés
Journal of Computational Chemistry
|
June 1, 2019
Quantum effects on the stability of the He<sub>5</sub> I<sub>2</sub> van der Waals conformers
Álvaro Valdés, Rita Prosmiti
The Journal of Physical Chemistry. A
|
December 5, 2015
Vibrational Calculations of Higher-Order Weakly Bound Complexes: The He3,4I2 Cases
Álvaro Valdés, Rita Prosmiti
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
June 15, 2013
First-principles simulations of vibrational states and spectra for H5(+) and D5(+) clusters using multiconfiguration time-dependent Hartree approach
Álvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics
|
September 15, 2014
Ab initio potential energy curves of the valence, Rydberg, and ion-pair states of iodine monochloride, ICl
Apostolos Kalemos, Rita Prosmiti
Physical Chemistry Chemical Physics : PCCP
|
February 25, 2014
Theoretical predictions on the role of the internal H3(+) rotation in the IR spectra of the H5(+) and D5(+) cations
Álvaro Valdés, Rita Prosmiti
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
June 5, 2024
Computational Modeling: Up-to-Date Approaches and Cutting-Edge Applications from Clusters, Nanostructures to Bulk Systems
Rita Prosmiti, Tomás González-Lezana
Page
of 7
Search research articles
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Showing results (1-10 of 70) with videos related to
Sort By:
Page
of 7
The Journal of Physical Chemistry. A
|
March 30, 2013
Quantum mechanical characterization of the He4ICl weakly bound complex
Álvaro Valdés, Rita Prosmiti
The Journal of Physical Chemistry. A
|
February 9, 2013
Theoretical investigation of the infrared spectra of the H5(+) and D5(+) cations
Álvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics
|
May 10, 2024
CO2 inside sI clathrate-like cages: Automated construction of neural network/machine learned guest-host potential and quantum spectra computations
Álvaro Valdés, Rita Prosmiti
Philosophical Transactions. Series A, Mathematical, Physical, and Engineering Sciences
|
August 6, 2019
The smallest proton-bound dimer H<sub>5</sub><sup>+</sup>: theoretical progress
Rita Prosmiti, Álvaro Valdés
Journal of Computational Chemistry
|
June 1, 2019
Quantum effects on the stability of the He<sub>5</sub> I<sub>2</sub> van der Waals conformers
Álvaro Valdés, Rita Prosmiti
The Journal of Physical Chemistry. A
|
December 5, 2015
Vibrational Calculations of Higher-Order Weakly Bound Complexes: The He3,4I2 Cases
Álvaro Valdés, Rita Prosmiti
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
June 15, 2013
First-principles simulations of vibrational states and spectra for H5(+) and D5(+) clusters using multiconfiguration time-dependent Hartree approach
Álvaro Valdés, Rita Prosmiti
The Journal of Chemical Physics
|
September 15, 2014
Ab initio potential energy curves of the valence, Rydberg, and ion-pair states of iodine monochloride, ICl
Apostolos Kalemos, Rita Prosmiti
Physical Chemistry Chemical Physics : PCCP
|
February 25, 2014
Theoretical predictions on the role of the internal H3(+) rotation in the IR spectra of the H5(+) and D5(+) cations
Álvaro Valdés, Rita Prosmiti
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
June 5, 2024
Computational Modeling: Up-to-Date Approaches and Cutting-Edge Applications from Clusters, Nanostructures to Bulk Systems
Rita Prosmiti, Tomás González-Lezana
Page
of 7