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potential-energy
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publication
Potential energy of totally positive algebraic integers
2022 |
Faculty of Mathematics and Physics
publication
Potential energy surface for spin-polarized rubidium trimer
2010 |
Faculty of Mathematics and Physics
publication
Morphing ab initio potential energy curve of beryllium monohydride
2016 |
Faculty of Mathematics and Physics
publication
Investigation of the benzene-dimer potential energy surface: DFT/CCSD(T) correction scheme (Article No. 114102)
2008 |
Faculty of Mathematics and Physics
publication
Investigation of the benzene-naphthalene and naphthalene-naphthalene potential energy surfaces: DFT/CCSD(T) correction scheme
2008 |
Faculty of Science, Central Library of Charles University
publication
Interatomic Coulombic decay in a He dimer: Ab initio potential-energy curves and decay widths
2010 |
Faculty of Mathematics and Physics
publication
New rotation-vibration band and potential energy function of NeH+ in the ground electronic state were obtained
2004 |
Faculty of Science
publication
New rotation-vibration band and potential energy function of NeH+ in the ground electronic state were obtained
2004 |
Faculty of Mathematics and Physics, First Faculty of Medicine
publication
Exploring the potential energy surface for interaction of a trichloro(diethylenetriamine)gold(III) complex with strong nucleophiles
2012 |
Faculty of Mathematics and Physics
publication
Exploring the Potential Energy Surface for the Interaction of Sterically Hindered Trichloro(diethylenetriamine)gold(III) Complexes with Water
2012 |
Faculty of Mathematics and Physics
publication
Accurate Prediction of Methane Adsorption in a Metal-Organic Framework with Unsaturated Metal Sites by Direct Implementation of an ab Initio Derived Potential Energy Surface in GCMC Simulation
2011 |
Faculty of Science
publication
Lowest autodetachment state of the water anion
2016 |
Faculty of Mathematics and Physics
publication
Radial molecular property functions of NO in its ground electronic state
2023 |
Faculty of Mathematics and Physics
publication
Radial molecular property functions of CH in its ground electronic state
2021 |
Faculty of Mathematics and Physics
publication
Radial molecular property functions of the A(2)Sigma(+) state of hydroxyl
2021 |
Faculty of Mathematics and Physics
publication
Morphing radial molecular property functions of hydroxyl
2020 |
Faculty of Mathematics and Physics
publication
DFT/CC investigation of physical adsorption on a graphite (0001) surface
2010 |
Faculty of Science, Central Library of Charles University
publication
Ab initio properties of MgAlk (Alk = Li, Na, K, Rb, Cs)
2012 |
Faculty of Mathematics and Physics
publication
Ultrafast imaging of laser-controlled non-adiabatic dynamics in NO2 from time-resolved photoelectron emission
2019 |
Faculty of Mathematics and Physics
publication
Accurate Description of Argon and Water Adsorption on Surfaces of Graphene-Based Carbon Allotropes
2011 |
Faculty of Science, Central Library of Charles University
publication
Radiative association of LiHe+
2012 |
Faculty of Mathematics and Physics
publication
Characterization of celluloses by means of viscoelastic parameters
2008 |
Faculty of Pharmacy in Hradec Králové
publication
Non-adiabatic dynamics in collisions of sodium and chlorine atoms and their ions
2022 |
Faculty of Mathematics and Physics
publication
A new approach to molecular dynamics with non-adiabatic and spin-orbit effects with applications to QM/MM simulations of thiophene and selenophene
2017 |
Faculty of Science
publication
Single-file transport of binary hard-sphere mixtures through periodic potentials
2023 |
Faculty of Mathematics and Physics
publication
Different Dynamics of CH3 and Cl Fragments from Photodissociation of CH3Cl in Clusters
2020 |
Faculty of Mathematics and Physics
publication
Role of Gold(I) alpha-Oxo Carbenes in the Oxidation Reactions of Alkynes Catalyzed by Gold(I) Complexes
2014 |
Faculty of Science
publication
A comparative icMRCI study of some NO+, NO and NO- electronic ground state properties
2004 |
Faculty of Science
publication
Europe and the Czech Republic stave off an energy collapse
2010 |
Publication without faculty affiliation
publication
Calculated relative populations for the Eu@C84 isomers
2020 |
Faculty of Science