Kolafa, J.
113  results:
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1

Novel barostat implementation for molecular dynamics:

Janek, Jiří ; Kolafa, Jiří
The Journal of Chemical Physics.  160 (2024)  18 - p. , 2024
 
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3

Does the Sign of Charge Affect the Surface Affinity of Simp..:

Hantal, György ; Klíma, Martin ; McFegan, Louisa..
The Journal of Physical Chemistry B.  127 (2023)  27 - p. 6205-6216 , 2023
 
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5

Polarization effects at the surface of aqueous alkali halid..:

Hantal, György ; Kolafa, Jiří ; Sega, Marcello.
https://discovery.ucl.ac.uk/id/eprint/10173664/1/1-s2.0-S0167732223011376-main.pdf.  , 2023
 
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7

Single-Particle Dynamics at the Intrinsic Surface of Aqueou..:

Hantal, György ; Kolafa, Jiří ; Sega, Marcello.
The Journal of Physical Chemistry B.  125 (2021)  2 - p. 665-679 , 2021
 
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8

Molecular Dynamics of Heterogeneous Systems on GPUs and The..:

Celný, David ; Klíma, Martin ; Kolafa, Jiří
Journal of Chemical Theory and Computation.  17 (2021)  12 - p. 7397-7405 , 2021
 
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9

Molecular Dynamics of Heterogeneous Systems on GPUs and The..:

David Celný (8882621) ; Martin Klíma (3598847) ; Jiří Kolafa (2150023)
https://figshare.com/articles/dataset/Molecular_Dynamics_of_Heterogeneous_Systems_on_GPUs_and_Their_Application_to_Nucleation_in_Gas_Expanding_to_a_Vacuum/17049847.  , 2021
 
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10

Molecular Dynamics of Heterogeneous Systems on GPUs and The..:

David Celný (8882621) ; Martin Klíma (3598847) ; Jiří Kolafa (2150023)
https://figshare.com/articles/journal_contribution/Molecular_Dynamics_of_Heterogeneous_Systems_on_GPUs_and_Their_Application_to_Nucleation_in_Gas_Expanding_to_a_Vacuum/17049850.  , 2021
 
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12

Surface Affinity of Alkali and Halide Ions in Their Aqueous..:

Hantal, György ; Horváth, Réka A. ; Kolafa, Jiří..
The Journal of Physical Chemistry B.  124 (2020)  44 - p. 9884-9897 , 2020
 
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13

Pressure in Molecular Simulations with Scaled Charges. 1. I..:

Kolafa, Jiří
The Journal of Physical Chemistry B.  124 (2020)  34 - p. 7379-7390 , 2020
 
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