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Ab Initio Investigation of Electronic Properties of the Magnesium Hydride Molecular Ion

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2013-09, Vol.117 (36), p.8915-8924

2013

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Adiabatic ab Initio Study of the BaH+ Ion Including High Energy Excited States

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2013-07, Vol.117 (26), p.5503-5517

2013

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One and Two-Electron Investigation of Electronic Structure for Ba+Xe and BaXe van der Waals Molecules in a Pseudopotential Approach

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2013-09, Vol.117 (36), p.8925-8938

2013

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Ab initio diabatic and adiabatic calculations for francium hydride FrH

New journal of chemistry, 2020-04, Vol.44 (14), p.5572-5587

2020

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Ab initio investigation of the electronic and vibrational properties for the (CaLi)+ ionic molecule

Molecular physics, 2016-05, Vol.114 (10), p.1568-1582

2016

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Theoretical study of the SrLi+ molecular ion: structural, electronic and dipolar properties

Molecular physics, 2016-10, Vol.114 (20), p.2910-2923

2016

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Ab Initio Adiabatic and Diabatic Energies and Dipole Moments of the CaH+ Molecular Ion

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-12, Vol.115 (48), p.14045-14053

2011

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Accurate Ab Initio Calculations for LiH and its Ions, LiH+ and LiH

Theoretical chemistry accounts, 2006-09, Vol.116 (4-5), p.566-575

2006

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Adiabatic and Diabatic Investigation of Numerous Electronic States for the Alkali Dimer FrNa

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2019-01, Vol.123 (2), p.544-555

2019

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Game of basis sets pinpointing charge transfer states: example for LiH

Theoretical chemistry accounts, 2023-10, Vol.142 (10), Article 95

2023

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Rotational Transitions in the N2+ Ion Induced by Collisions with Helium Atoms in Cold Helium Plasmas. A Quasiclassical Trajectory Study

Chemphyschem, 2024-01, Vol.25 (1), p.e202300469-n/a

2024

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Data on Inelastic Processes in Low-energy Calcium-Hydrogen Ionic Collisions

The Astrophysical journal, 2018-11, Vol.867 (2), p.87

2018

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Ab initio calculation of the electronic structure of the strontium hydride ion (SrH+)

International journal of quantum chemistry, 2015-02, Vol.115 (3), p.172-186

2015

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Non-adiabatic dynamics combining Ehrenfest, decoherence, and multiscale approaches applied to ionic rare-gas clusters photodissociation, post-ionization fragmentation, and collisions

Computational and theoretical chemistry, 2019-04, Vol.1153, p.54-64

2019

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Charge transfer ionic character illustration for strontium hydride ion through a diabatic investigation

International journal of quantum chemistry, 2018-09, Vol.118 (18), p.n/a

2018

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PAH chemistry at eV internal energies. 2. Ring alteration and dissociation

Molecular Astrophysics, 2017-06, Vol.7, p.37-59

2017

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Spectroscopic ab initio investigation of the electronic properties of (SrK)

Chemical physics, 2017-06, Vol.490, p.19-28

2017

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An adiabatic spectroscopic investigation of the CsRb system in ground and numerous excited states

Journal of quantitative spectroscopy & radiative transfer, 2017-10, Vol.200, p.173-189

2017

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Ab Initio Diabatic energies and dipole moments of the electronic states of RbLi molecule

Journal of computational chemistry, 2013-09, Vol.34 (24), p.2091-2099

2013

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PAH chemistry at eV internal energies. 1. H-shifted isomers

Molecular Astrophysics, 2017-06, Vol.7, p.27-36

2017

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Theoretical study of the electronic structure of LiX and NaX (X = Rb, Cs) molecules

International journal of quantum chemistry, 2012-08, Vol.112 (15), p.2724-2734

2012

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Relaxation of electronic excitations in Kr 2 + ions in cold krypton plasma

Plasma sources science & technology, 2020-02, Vol.29 (2)

2020

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Ab initio spectroscopic study for the NaRb molecule in ground and excited states

International journal of quantum chemistry, 2014-06, Vol.114 (11), p.731-747

2014

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Spectroscopic and structural investigation for the ground and excited states of CaNa+ molecular ion

Journal of quantitative spectroscopy & radiative transfer, 2018-04, Vol.209, p.45-57

2018

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Quantum and semi-classical collision cross-sections and transport data for a Kr+/Kr system

Plasma sources science & technology, 2018-06, Vol.27 (6), p.65005

2018

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Ab Initio Investigation of Electronic Properties of the Magnesium Hydride Molecular Ion

Adiabatic ab Initio Study of the BaH+ Ion Including High Energy Excited States

One and Two-Electron Investigation of Electronic Structure for Ba+Xe and BaXe van der Waals Molecules in a Pseudopotential Approach

Ab initio diabatic and adiabatic calculations for francium hydride FrH

Ab initio investigation of the electronic and vibrational properties for the (CaLi)+ ionic molecule

Theoretical study of the SrLi+ molecular ion: structural, electronic and dipolar properties

Ab Initio Adiabatic and Diabatic Energies and Dipole Moments of the CaH+ Molecular Ion

Accurate Ab Initio Calculations for LiH and its Ions, LiH+ and LiH

Adiabatic and Diabatic Investigation of Numerous Electronic States for the Alkali Dimer FrNa

Game of basis sets pinpointing charge transfer states: example for LiH

Rotational Transitions in the N2+ Ion Induced by Collisions with Helium Atoms in Cold Helium Plasmas. A Quasiclassical Trajectory Study

Data on Inelastic Processes in Low-energy Calcium-Hydrogen Ionic Collisions

Ab initio calculation of the electronic structure of the strontium hydride ion (SrH+)

Non-adiabatic dynamics combining Ehrenfest, decoherence, and multiscale approaches applied to ionic rare-gas clusters photodissociation, post-ionization fragmentation, and collisions

Charge transfer ionic character illustration for strontium hydride ion through a diabatic investigation

PAH chemistry at eV internal energies. 2. Ring alteration and dissociation

Spectroscopic ab initio investigation of the electronic properties of (SrK)

An adiabatic spectroscopic investigation of the CsRb system in ground and numerous excited states

Ab Initio Diabatic energies and dipole moments of the electronic states of RbLi molecule

PAH chemistry at eV internal energies. 1. H-shifted isomers

Theoretical study of the electronic structure of LiX and NaX (X = Rb, Cs) molecules

Relaxation of electronic excitations in Kr 2 + ions in cold krypton plasma

Ab initio spectroscopic study for the NaRb molecule in ground and excited states

Spectroscopic and structural investigation for the ground and excited states of CaNa+ molecular ion

Quantum and semi-classical collision cross-sections and transport data for a Kr+/Kr system

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