Lista de obras - Piotr Jankowski - Dominio Público Uruguay

A comprehensive experimental and theoretical study of H2−CO spectra

scientific article published on 01 February 2013

A new ab initio interaction energy surface and high-resolution spectra of the H2-CO van der Waals complex

scientific article published on 01 September 2005

Ab initio potential energy surface and infrared spectra of H2-CO and D2-CO van der Waals complexes

artículo científico publicado en 1998

Ab initio water pair potential with flexible monomers

artículo científico publicado en 2015

Absolute measurements of state-to-state rotational energy transfer between CO and H 2 at interstellar temperatures

artículo científico publicado en 2022

All-dimensional H2-CO potential: Validation with fully quantum second virial coefficients.

artículo científico publicado en 2017

Applicability of single-reference coupled-cluster methods to excited states. A model study

artículo científico publicado en 1994

Approximate generation of full-dimensional ab initio van der Waals surfaces for high-resolution spectroscopy

artículo científico publicado en 2004

Basis Set Convergence of the Post-CCSD(T) Contribution to Noncovalent Interaction Energies

artículo científico publicado en 2014

Comparative experimental and theoretical study of the rotational excitation of CO by collision with ortho- and para-D2 molecules

artículo científico publicado en 2016

Effects of monomer flexibility on spectra of N2–HF

artículo científico publicado en 2008

Evidence of Nonrigidity Effects in the Description of Low-Energy Anisotropic Molecular Collisions of Hydrogen Molecules with Excited Metastable Helium Atoms

artículo científico publicado en 2020

Experimental and theoretical analysis of low-energy CO + H_2_ inelastic collisions ⬇️

scholarly article

Exploring the new three-dimensional ab initio interaction energy surface of the Ar-HF complex: rovibrational calculations for Ar-HF and Ar-DF with vibrationally excited diatoms

artículo científico publicado en 2008

Fitting the derivative surfaces for full-dimensional interaction potentials

artículo científico publicado en 2006

Fully quantum calculation of the second and third virial coefficients of water and its isotopologues from ab initio potentials

artículo científico publicado en 2018

Intermolecular potential of carbon dioxide dimer from symmetry-adapted perturbation theory

artículo científico publicado en 1999

Kinetic Isotope Effect in Low-Energy Collisions between Hydrogen Isotopologues and Metastable Helium Atoms: Theoretical Calculations Including the Vibrational Excitation of the Molecule

artículo científico publicado en 2021

Multiple solutions of the single-reference coupled-cluster equations. I. H4 model revisited

artículo científico publicado en 1994

Multiple solutions of the single-reference coupled-cluster equations. II. Alternative reference states

artículo científico publicado en 1995

On the importance of full-dimensionality in low-energy molecular scattering calculations

artículo científico publicado en 2016

On the optimal choice of monomer geometry in calculations of intermolecular interaction energies: Rovibrational spectrum of Ar–HF from two- and three-dimensional potentials

artículo científico publicado en 2000

On the role of coupled-clusters' full triple and perturbative quadruple excitations on rovibrational spectra of van der Waals complexes

artículo científico publicado en 2021

Path-integral calculation of the second virial coefficient including intramolecular flexibility effects.

artículo científico publicado en 2014

Portable parallel implementation of symmetry-adapted perturbation theory code

artículo científico publicado en 2006

Potential energy surface for interactions between two hydrogen molecules

artículo científico publicado en 2008

Predicting the infrared transition intensities in the Ar-HF complex: the key role of the dipole moment surface accuracy

scientific article published on 01 January 2008

Second virial coefficients of H2 and its isotopologues from a six-dimensional potential

scientific article published on 01 October 2012

Spectra of N2–HF from symmetry-adapted perturbation theory potential

artículo científico publicado en 2001

Symmetry-adapted perturbation theory of three-body nonadditivity in the Ar2HF trimer

artículo científico publicado en 1998

Symmetry‐adapted perturbation theory calculation of the intra‐atomic correlation contribution to the short‐range repulsion of helium atoms

artículo científico publicado en 1990

Theory untangles the high-resolution infrared spectrum of the ortho-H2-CO van der Waals complex

artículo científico publicado en 2012

Unitary group approach to spin-adapted open-shell coupled cluster theory

artículo científico publicado en 1995

Unitary group based open-shell coupled cluster theory: Application to van der Waals interactions of high-spin systems

artículo científico publicado en 1999

Lista de obras de Piotr Jankowski

A comprehensive experimental and theoretical study of H2−CO spectra

A new ab initio interaction energy surface and high-resolution spectra of the H2-CO van der Waals complex

Ab initio potential energy surface and infrared spectra of H2-CO and D2-CO van der Waals complexes

Ab initio water pair potential with flexible monomers

Absolute measurements of state-to-state rotational energy transfer between CO and H 2 at interstellar temperatures

All-dimensional H2-CO potential: Validation with fully quantum second virial coefficients.

Applicability of single-reference coupled-cluster methods to excited states. A model study

Approximate generation of full-dimensional ab initio van der Waals surfaces for high-resolution spectroscopy

Basis Set Convergence of the Post-CCSD(T) Contribution to Noncovalent Interaction Energies

Comparative experimental and theoretical study of the rotational excitation of CO by collision with ortho- and para-D2 molecules

Effects of monomer flexibility on spectra of N2–HF

Evidence of Nonrigidity Effects in the Description of Low-Energy Anisotropic Molecular Collisions of Hydrogen Molecules with Excited Metastable Helium Atoms

Experimental and theoretical analysis of low-energy CO + H_2_ inelastic collisions ⬇️

Exploring the new three-dimensional ab initio interaction energy surface of the Ar-HF complex: rovibrational calculations for Ar-HF and Ar-DF with vibrationally excited diatoms

Fitting the derivative surfaces for full-dimensional interaction potentials

Fully quantum calculation of the second and third virial coefficients of water and its isotopologues from ab initio potentials

Intermolecular potential of carbon dioxide dimer from symmetry-adapted perturbation theory

Kinetic Isotope Effect in Low-Energy Collisions between Hydrogen Isotopologues and Metastable Helium Atoms: Theoretical Calculations Including the Vibrational Excitation of the Molecule

Multiple solutions of the single-reference coupled-cluster equations. I. H4 model revisited

Multiple solutions of the single-reference coupled-cluster equations. II. Alternative reference states

On the importance of full-dimensionality in low-energy molecular scattering calculations

On the optimal choice of monomer geometry in calculations of intermolecular interaction energies: Rovibrational spectrum of Ar–HF from two- and three-dimensional potentials

On the role of coupled-clusters' full triple and perturbative quadruple excitations on rovibrational spectra of van der Waals complexes

Path-integral calculation of the second virial coefficient including intramolecular flexibility effects.

Portable parallel implementation of symmetry-adapted perturbation theory code

Potential energy surface for interactions between two hydrogen molecules

Predicting the infrared transition intensities in the Ar-HF complex: the key role of the dipole moment surface accuracy

Second virial coefficients of H2 and its isotopologues from a six-dimensional potential

Spectra of N2–HF from symmetry-adapted perturbation theory potential

Symmetry-adapted perturbation theory of three-body nonadditivity in the Ar2HF trimer

Symmetry‐adapted perturbation theory calculation of the intra‐atomic correlation contribution to the short‐range repulsion of helium atoms

Theory untangles the high-resolution infrared spectrum of the ortho-H2-CO van der Waals complex

Unitary group approach to spin-adapted open-shell coupled cluster theory

Unitary group based open-shell coupled cluster theory: Application to van der Waals interactions of high-spin systems