フォロー
Avula V S Nikhil
Avula V S Nikhil
Ph. D. student, JNCASR
確認したメール アドレス: jncasr.ac.in
タイトル
引用先
引用先
Charge environment and hydrogen bond dynamics in binary ionic liquid mixtures: A computational study
NVS Avula, A Mondal, S Balasubramanian
The Journal of Physical Chemistry Letters 9 (12), 3511-3516, 2018
152018
Efficient parametrization of force field for the quantitative prediction of the physical properties of ionic liquid electrolytes
NVS Avula, A Karmakar, R Kumar, S Balasubramanian
Journal of Chemical Theory and Computation 17 (7), 4274-4290, 2021
142021
Refined force field for liquid sulfolane with particular emphasis to its transport characteristics
S Mukherji, NVS Avula, S Balasubramanian
ACS omega 5 (43), 28285-28295, 2020
132020
Hopping in high concentration electrolytes-long time bulk and single-particle signatures, free energy barriers, and structural insights
S Mukherji, NVS Avula, R Kumar, S Balasubramanian
The journal of physical chemistry letters 11 (22), 9613-9620, 2020
122020
Insights into the stabilization of fluoride ions in ionic liquids: Pointers to better fluorinating agents
A Gaur, NVS Avula, S Balasubramanian
The Journal of Physical Chemistry B 124 (40), 8844-8856, 2020
62020
Building robust machine learning models for small chemical science data: the case of shear viscosity of fluids
NVS Avula, SK Veesam, S Behera, S Balasubramanian
Machine Learning: Science and Technology 3 (4), 045032, 2022
42022
Understanding the anomalous diffusion of water in aqueous electrolytes using machine learned potentials
NVS Avula, ML Klein, S Balasubramanian
The Journal of Physical Chemistry Letters 14 (42), 9500-9507, 2023
22023
Building Robust Machine Learning Models for Small Chemical Science Data: The Case of Shear Viscosity
NVS Avula, SK Veesam, S Behera, S Balasubramanian
arXiv preprint arXiv:2208.10784, 2022
2022
Modelling room temperature ionic liquids: charge environment, hydrogen bond dynamics and related phenomena
AVS Nikhil
Jawaharlal Nehru Centre for Advanced Scientific Research, 2019
2019
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論文 1–9