Number of items: 5.
Article
Kayal, Abhijit ; Chandra, Amalendu
(2019)
Water in Confinement between Nanowalls: Results for Hexagonal Boron Nitride versus Graphene Sheets from Ab Initio Molecular Dynamics
The Journal of Physical Chemistry C, 123
(10).
pp. 6130-6140.
ISSN 1932-7447
Kayal, Abhijit ; Chandra, Amalendu
(2017)
Infrared Spectral and Dynamical Properties of Water Confined in Nanobubbles at Hybrid Interfaces of Diamond and Graphene: A Molecular Dynamics Study
The Journal of Physical Chemistry C, 121
(42).
pp. 23455-23462.
ISSN 1932-7447
Kayal, Abhijit ; Chandra, Amalendu
(2017)
Orientational order and dynamics of interfacial water near a hexagonal boron-nitride sheet: An ab initio molecular dynamics study
The Journal of Chemical Physics, 147
(16).
p. 164704.
ISSN 0021-9606
Kayal, Abhijit ; Chandra, Amalendu
(2015)
Exploring the structure and dynamics of nano-confined water molecules using molecular dynamics simulations
Molecular Simulation, 41
(5-6).
pp. 463-470.
ISSN 0892-7022
Kayal, Abhijit ; Chandra, Amalendu
(2015)
Wetting and dewetting of narrow hydrophobic channels by orthogonal electric fields: Structure, free energy, and dynamics for different water models
The Journal of Chemical Physics, 143
(22).
p. 224708.
ISSN 0021-9606
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