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Journal of Chemical Theory and Computation
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April 25, 2017
Many-Body Energy Decomposition with Basis Set Superposition Error Corrections
István Mayer, Imre Bakó
The Journal of Physical Chemistry. A
|
January 16, 2016
Hierarchy of the Collective Effects in Water Clusters
Imre Bakó, István Mayer
The Journal of Physical Chemistry. A
|
June 10, 2016
On Dipole Moments and Hydrogen Bond Identification in Water Clusters
Imre Bakó, István Mayer
Molecules (Basel, Switzerland)
|
April 26, 2025
Can We Unambiguously Define the Dipole Moment of Molecules in the Condensed Phase?
Imre Bakó, Szilvia Pothoczki
The Journal of Chemical Physics
|
November 19, 2025
Pressure-dependent structure of neat liquid methanol, CH3OH: Molecular dynamics simulations with various united atom-type potentials
Imre Bakó, László Pusztai, Orest Pizio
The Journal of Physical Chemistry. B
|
March 30, 2023
Connecting Diffraction Experiments and Network Analysis Tools for the Study of Hydrogen-Bonded Networks
Imre Bakó, Szilvia Pothoczki, László Pusztai
The Journal of Physical Chemistry. B
|
August 14, 2019
Molecular Dynamics Simulation Studies of the Temperature-Dependent Structure and Dynamics of Isopropanol-Water Liquid Mixtures at Low Alcohol Content
Szilvia Pothoczki, László Pusztai, Imre Bakó
Molecules (Basel, Switzerland)
|
May 25, 2024
Systematic Study of Different Types of Interactions in α-, β- and γ-Cyclodextrin: Quantum Chemical Investigation
Imre Bakó, László Jicsinszky, Szilvia Pothoczki
Physical Chemistry Chemical Physics : PCCP
|
May 6, 2020
Chloride ions as integral parts of hydrogen bonded networks in aqueous salt solutions: the appearance of solvent separated anion pairs
Ildikó Pethes, Imre Bakó, László Pusztai
ACS Omega
|
May 13, 2024
Outstanding Properties of the Hydration Shell around β-d-Glucose: A Computational Study
Imre Bakó, László Pusztai, Szilvia Pothoczki
Page
of 4
Search research articles
Search
Showing results (1-10 of 34) with videos related to
Sort By:
Page
of 4
Journal of Chemical Theory and Computation
|
April 25, 2017
Many-Body Energy Decomposition with Basis Set Superposition Error Corrections
István Mayer, Imre Bakó
The Journal of Physical Chemistry. A
|
January 16, 2016
Hierarchy of the Collective Effects in Water Clusters
Imre Bakó, István Mayer
The Journal of Physical Chemistry. A
|
June 10, 2016
On Dipole Moments and Hydrogen Bond Identification in Water Clusters
Imre Bakó, István Mayer
Molecules (Basel, Switzerland)
|
April 26, 2025
Can We Unambiguously Define the Dipole Moment of Molecules in the Condensed Phase?
Imre Bakó, Szilvia Pothoczki
The Journal of Chemical Physics
|
November 19, 2025
Pressure-dependent structure of neat liquid methanol, CH3OH: Molecular dynamics simulations with various united atom-type potentials
Imre Bakó, László Pusztai, Orest Pizio
The Journal of Physical Chemistry. B
|
March 30, 2023
Connecting Diffraction Experiments and Network Analysis Tools for the Study of Hydrogen-Bonded Networks
Imre Bakó, Szilvia Pothoczki, László Pusztai
The Journal of Physical Chemistry. B
|
August 14, 2019
Molecular Dynamics Simulation Studies of the Temperature-Dependent Structure and Dynamics of Isopropanol-Water Liquid Mixtures at Low Alcohol Content
Szilvia Pothoczki, László Pusztai, Imre Bakó
Molecules (Basel, Switzerland)
|
May 25, 2024
Systematic Study of Different Types of Interactions in α-, β- and γ-Cyclodextrin: Quantum Chemical Investigation
Imre Bakó, László Jicsinszky, Szilvia Pothoczki
Physical Chemistry Chemical Physics : PCCP
|
May 6, 2020
Chloride ions as integral parts of hydrogen bonded networks in aqueous salt solutions: the appearance of solvent separated anion pairs
Ildikó Pethes, Imre Bakó, László Pusztai
ACS Omega
|
May 13, 2024
Outstanding Properties of the Hydration Shell around β-d-Glucose: A Computational Study
Imre Bakó, László Pusztai, Szilvia Pothoczki
Page
of 4