Yashonath Subramanian

发表

A molecular dynamics study of ambient and high pressure phases of silica: structure and enthalpy variation with molar volume.

J. Gopalakrishnan, Chitra Rajappa, S. B. Sringeri, 2014, The Journal of chemical physics.

A new empirical potential for zeolite with variable Si/Al ratio: Simulations vs. experiments

S. Uma, S. Nag, Shrishti Uniyal, 2020 .

Diffusion of pentane isomers in faujasite-type zeolites : NMR and molecular dynamics study

J. Kärger, P. Galvosas, B. Borah, 2013 .

Diffusion processes in a poly-crystalline zeolitic material: A molecular dynamics study.

Yashonath Subramanian, A. M. Thomas, 2018, The Journal of chemical physics.

Bridging the gap between diffusivities from experiment and molecular dynamics: n-hexane and 2,2-dimethyl butane in zeolite BEA

Yashonath Subramanian, A. M. Thomas, 2019, Microporous and Mesoporous Materials.

Hexane Isomers in Faujasite: Anomalous Diffusion and Kinetic Separation

Yashonath Subramanian, A. M. Thomas, 2017 .

Simulations on “Powder” Samples for Better Agreement with Macroscopic Measurements

Yashonath Subramanian, A. M. Thomas, 2019, The Journal of Physical Chemistry C.

Separation of hydrocarbon mixture of neopentane and n‐hexane using NaY zeolite: Large distinct diffusivity

S. Nag, Yashonath Subramanian, 2022, J. Comput. Chem..

Understanding Translational-Rotational Coupling in Liquid Water through Changes in Mass Distribution.

Dhivya Manogaran, Yashonath Subramanian, 2017, The journal of physical chemistry. B.

Anomalous Diffusivity in Porous Solids: Levitation Effect

S. Nag, Yashonath Subramanian, 2020, Zeolites - New Challenges.

High purity separation of n-pentane from neopentane using a nano-crystal of zeolite Y.

G. Ananthakrishna, S. Nag, P. Maiti, 2021, The Journal of chemical physics.

Shared hydrogen bonds: water in aluminated faujasite.

G. Reddy, S. Durani, Yashonath Subramanian, 2020, Physical chemistry chemical physics : PCCP.

A molecular dynamics calculation of solid phase of malonic acid: role of hydrogen-bond chains and the elastic constants

S. Perumal, Yashonath Subramanian, 2017, Journal of Chemical Sciences.

Concentration Dependent Self-Assembly of TrK-NGF Receptor Derived Tripeptide: New Insights from Experiment and Computer Simulations.

S. Bhattacharya, P. Moitra, Yashonath Subramanian, 2017, The journal of physical chemistry. B.

High Interfacial Barriers at Narrow Carbon Nanotube-Water Interfaces.

S. Bhatia, S. Varanasi, Yashonath Subramanian, 2018, Langmuir : the ACS journal of surfaces and colloids.

Effect of pressure on the ionic conductivity of Li+ and Cl- ions in water.

Parveen Kumar, S. Varanasi, Yashonath Subramanian, 2012, The Journal of chemical physics.

Monte Carlo and molecular dynamics simulation of argon clusters andn-alkanes in the confined regions of zeolites

S. Bandyopadhyay, Chitra Rajappa, Yashonath Subramanian, 1997 .