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The Journal of Physical Chemistry. A
|
April 1, 2014
Reactive molecular dynamics simulation on the disintegration of Kapton, POSS polyimide, amorphous silica, and teflon during atomic oxygen impact using the ReaxFF reactive force-field method
A Rahnamoun, A C T van Duin
Physical Chemistry Chemical Physics : PCCP
|
December 17, 2015
Study of thermal conductivity of ice clusters after impact deposition on the silica surfaces using the ReaxFF reactive force field
A Rahnamoun, A C T van Duin
The Journal of Physical Chemistry. B
|
November 4, 2014
Reactive molecular dynamics study of the pH-dependent dynamic structure of α-helix
M Golkaram, Y K Shin, A C T van Duin
The Journal of Physical Chemistry. A
|
September 3, 2011
Reactive molecular dynamics study on the first steps of DNA damage by free hydroxyl radicals
Ramin M Abolfath, A C T van Duin, Thomas Brabec
The Journal of Chemical Physics
|
May 19, 2025
Iodine recombination in xenon solvent: Clusters in the gas to liquid-like state transition
M Mirakhory, A Majumdar, M Ihme, et al.
The Journal of Chemical Physics
|
March 4, 2026
Dynamics of iodine geminate recombination in supercritical xenon solvent: Caging effect
M Mirakhory, A Majumdar, M Ihme, et al.
Nanotechnology
|
February 11, 2012
Can amorphization take place in nanoscale interconnects?
S Kumar, K L Joshi, A C T van Duin, et al.
Physical Chemistry Chemical Physics : PCCP
|
December 22, 2025
Suitability of the ReaxFF potential for MD modeling of lithium across low and high temperatures
P S Krstic, S Dwivedi, A C T van Duin, et al.
The Journal of Chemical Physics
|
September 8, 2019
ReaxFF reactive force field for molecular dynamics simulations of liquid Cu and Zr metals
H S Huang, L Q Ai, A C T van Duin, et al.
The Journal of Physical Chemistry. A
|
November 20, 2024
Computational Insights into Tunable Reversible Network Materials: Accelerated ReaxFF Kinetics of Furan-Maleimide Diels-Alder Reactions for Self-Healing and Recyclability
L Vermeersch, T Wang, N Van den Brande, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 16) with videos related to
Sort By:
Page
of 2
The Journal of Physical Chemistry. A
|
April 1, 2014
Reactive molecular dynamics simulation on the disintegration of Kapton, POSS polyimide, amorphous silica, and teflon during atomic oxygen impact using the ReaxFF reactive force-field method
A Rahnamoun, A C T van Duin
Physical Chemistry Chemical Physics : PCCP
|
December 17, 2015
Study of thermal conductivity of ice clusters after impact deposition on the silica surfaces using the ReaxFF reactive force field
A Rahnamoun, A C T van Duin
The Journal of Physical Chemistry. B
|
November 4, 2014
Reactive molecular dynamics study of the pH-dependent dynamic structure of α-helix
M Golkaram, Y K Shin, A C T van Duin
The Journal of Physical Chemistry. A
|
September 3, 2011
Reactive molecular dynamics study on the first steps of DNA damage by free hydroxyl radicals
Ramin M Abolfath, A C T van Duin, Thomas Brabec
The Journal of Chemical Physics
|
May 19, 2025
Iodine recombination in xenon solvent: Clusters in the gas to liquid-like state transition
M Mirakhory, A Majumdar, M Ihme, et al.
The Journal of Chemical Physics
|
March 4, 2026
Dynamics of iodine geminate recombination in supercritical xenon solvent: Caging effect
M Mirakhory, A Majumdar, M Ihme, et al.
Nanotechnology
|
February 11, 2012
Can amorphization take place in nanoscale interconnects?
S Kumar, K L Joshi, A C T van Duin, et al.
Physical Chemistry Chemical Physics : PCCP
|
December 22, 2025
Suitability of the ReaxFF potential for MD modeling of lithium across low and high temperatures
P S Krstic, S Dwivedi, A C T van Duin, et al.
The Journal of Chemical Physics
|
September 8, 2019
ReaxFF reactive force field for molecular dynamics simulations of liquid Cu and Zr metals
H S Huang, L Q Ai, A C T van Duin, et al.
The Journal of Physical Chemistry. A
|
November 20, 2024
Computational Insights into Tunable Reversible Network Materials: Accelerated ReaxFF Kinetics of Furan-Maleimide Diels-Alder Reactions for Self-Healing and Recyclability
L Vermeersch, T Wang, N Van den Brande, et al.
Page
of 2