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Chapters in Books :

I. K. Puri and S. Murad, “Multiscale Methodology to Approach Nanoscale Thermal Transport”, in, Trends in Computational Nanomechanics: Transcending Time and Space, Chapter 5, p. 135-150, T. Dumitrica (Ed.), Springer, Heidelberg, (2010).

S. Murad,and J. G. Powles "Fluids in Contact with Semi-Permeable Membranes ", Computational Methods in Surface Science, M. Borowko (Ed.), Marcel-Dekker, New York, p. 775 (2000).

P. Ravi, and S. Murad, "Thermal Conductivity of Mixtures of Polyatomic Fluids Using Nonequilibrium Molecular Dynamics", Molecular Simulation and Industrial Application: Methods, Examples and Prospects, K. E. Gubbins and N. Quirke (Eds.), Gordon and Breach, Amsterdam, p. 307 (1996).

S. Murad, and K. A. Mansur, "Viscosity of Fluids", Encyclopedia of Fluid Mechanics, Vol. 8, Chapter 1, N. P. Chermisinoff (Editor), Gulf Publishing, Houston, p. 3-19 (1989).

 

Selected Publications:

J. K. Floess and S.Murad, “Molecular Simulations of the Competitive Adsorption of Siloxanes and Water on Amorphous Silica Surfaces as a function of Temperature”, Chemical Physics Letters, in press (2011).

B. Song, H. Yuan, C.J.Jameson and S.Murad, “Permeation of nanocrystals across lipid membrane”, Molecular Physics, 109, 1511-1526, (2011).

G. Balasubramanian, S. Murad, R. Kappiyoor and I. K. Puri, “Structure of Aqueous MgSO4 Solution: Dilute to Concentrated”, Chemical Physics Letters,508, 38-42 (2011).

S. Murad, “The role of external electric fields in enhancing ion mobility, drift velocity, and drift¨Cdiffusion rates in aqueous electrolyte solutions”, Journal of Chemical Physics,134, 114504 (2011).

N. Sedighi, S. Murad , and S. K. Aggarwal, “Molecular Dynamics Simulations of Spontaneous Spreading of a Nanodroplet on Solid Surfaces”, Fluid Dynamics Research,43, 015507, (2011).

H. Yuan, C. Gosling, P. Kokayeff and S. Murad, “Prediction of Hydrogen Solubility in Heavy Hydrocarbons over a Range of Temperatures and Pressures using Molecular Dynamics Simulations”, Fluid Phase Equilbria, 94-101 ,299, (2010).

S. Murad and I. K. Puri, “Anomalous Flow Behavior in Closed and Open Thin Walled Nanochannels”, Physics Letters A, 374 ,4242–46 (2010)

S. Murad, L. Luo and L-Y Chu, “Anomalous Flow Behavior in Nanochannels: A Molecular Dynamics Study”, Chemical Physics Letters, 492, 285-289 (2010)

H. Yuan, C. J. Jameson and S.Murad, “Diffusion of Gases across Lipid Membranes with OmpA Channel: A Molecular Dynamics Study”, Molecular Physics, 12, 1569-1581 (2010)

A. Malani, S. Murad, and K. G. Ayappa, “Hydration of Ions Under Confinement”, Molecular Simulation, 36, 579-589 (2010)

N. Sedighi, S. Murad, and S. K. Aggarwal, “Molecular Dynamics Simulations of Nanodroplet Spreading on Solid Surfaces; Effect of Droplet Size”, Fluid Dynamics Research, 42 ,035501[1-23]  (2010)

S. Murad and I.K. Puri, "Thermal Transport Through Superlattice Solid-Solid Interfaces", Applied Physics Letters, 95, 051907 (2009).

A. Malani, K. G. Ayappa, S. Murad, "Influence of Hydrophilic Surface Specificity on the Structural Properties of Confined Water", Journal of Physical Chemistry B, in press (2009).

S. Murad, and I. K. Puri, “Thermal transport through a fluid-solid interface”, Chemical Physics Letters, 476, 267-70 (2009).

H. Yuan, C. J. Jameson, and S. Murad, “ Exploring Gas Permeability of Lipid Membranes Using Coarse Grained Molecular Dynamics”, Molecular Simulation, 35, 953-961(2009)

N. Sedighi, S. Murad, and S. K. Aggarwal, “Molecular Dynamics Simulations of Nano-Droplet Wetting on a Solid Surface”, Atomization and Sprays, 19, 191-205 (2009).

S. Murad and I. K. Puri, Molecular Simulation of Thermal Transport Across Hydrophilic Surfaces, Chemical Physics Letters, in press (2008)

H. Yuan, C. J. Jameson, S. K. Gupta, J. D. Olson and S. Murad, “Prediction of Henry's Constants of Xenon in cyclo-alkanes from Molecular Dynamics Simulations”, Fluid Phase Equilibria, 269, 73-79 (2008)

S. Murad, and I. K. Puri, ‘Thermal Transport Across Nanoscale Solid-Fluid Interfaces”, Applied Physics Letters, 92, 133105 (2008).

H. Liu, C. J. Jameson, and S. Murad,” Molecular Dynamics Simulation of Ion Selectivity Process in Nanopores”, Molecular Simulation, 34, 169-175(2008)

N. Sedighi, S. Murad, and S. K. Aggarwal, “Molecular Dynamics Simulations of Nano-Droplet Wetting on a Solid Surface”, Atomization and Sprays, in press (2008).

S. Murad and I. K. Puri, “Nanoscale Jet Collision and Mixing Dynamics”, Nano Letters, 7, 707-712 (2007).

H.Yuan, S.Murad and C.J.Jameson,  Molecular Dynamics Simulations of Xe Chemical Shifts and Solubility in n-Alkanes, Journal of Physical Chemistry C, 111 (43)15771-15783,2007

S. Banerjee, S. Murad and I. K. Puri,  Preferential Ion and Water Intake Using Charged Carbon Nanotubes, Chemical Physics Letters, 434292-296, 2007

S. Murad,  The Role of Magnetic Fields on the Membrane-Based Separation of Aqueous Electrolyte Solutions, Chemical Physics Letters, 417(465)470, 2006

M. Krishnamurthy, S. Murad and J. D. Olson, Molecular Dynamics Simulation of Henry's constant of Argon, Nitrogen, Methane and Oxygen in Ethylene Oxide, Molecular Simulation, 3211-16, 2006

W. Jia, S. Murad,  Molecular Dynamics Simulation of Pervaporation in Zeolite Membranes, Molecular Physics, 1043033-3043,2006

S. Banerjee, S. Murad, and I. K. Puri, Hydrogen Storage in Carbon Nanostructures: Possibilities and Challenges for Fundamental Molecular Simulations, Proceedings of the IEEE, 941806-1814,2006

H. Liu, S. Murad, and C. J. Jameson, Ion Permeation Dynamics in Carbon Nanotubes, Journal of Chemical Physics, 125(084713)1-12, 2006

A. Malani, K. G. Ayappa, and S. Murad, Effect of Confinement on the Hydration and Solubility of NaCl in Water, Chemical Physics Letters, 43188-93, 2006

W. Jia and S. Murad , Separation of Gas Mixtures Using a Range of Zeolite Membranes: A Molecular Dynamics Study, Journal of Chemical Physics, 122(234708), 2005

J. Zhan, J. Dong, M. Luo, H. Xiao, S. Murad ,R. A. Normann (2005) Zeolite-Fiber Integrated Optical Chemical Sensors for Detection of Dissolved Organics in Water, Langmuir, 21(8609)8612

W. Jia, S. Murad, Molecular Dynamics Simulations of Gas Separations Using FAU-Type Zeolite Membranes, Journal of Chemical Physics, 1204877-4885, 2004

S. Murad, L. C. Nitsche, The Effect of Thickness, Pore Size and Structure of a Nanomembrane on the Flux and Selectivity in Reverse Osmosis Separations: A Molecular Dynamics Study, Chemical Physics Letters, 397211-215, 2004

C. J. Jameson, D. N. Sears, S. Murad, Molecular Dynamics Averaging of Xe Chemical Shifts in Liquids, Journal of Chemical Physicsin press, 2004

S. Murad, W. Jia, M. Krishnamurthy, Ion-Exchange of Monovalent and Bivalent Cations with NaA Zeolite Membranes: A Molecular Dynamics Study, Molecular Physicsin press, 2004

L. Consolini, S. K. Aggarwal, S. Murad, A Molecular Dynamics Simulation of Droplet Evaporation, International Journal of Heat and Mass Transfer, 463179-3188, 2003

S. Murad, W. Jia, M. Krishnamurthy, Molecular Simulations of Ion Exchange in NaA Zeolite Membranes, Chemical Physics Letters, 369402-8, 2003

C.J. Jameson, S. Murad, On Using NMR Chemical Shift to Assess Polar-Nonpolar Cross-, Chemical Physics Letters, 380556-562, 2003

E. Enciso, N. G. Almarza, S. Murad, M. A. Gonzalez, A Nonequilibrium Molecular Dynamics Approach to Fluid Transfer Through Microporous Membranes, Molecular Physics, 1002337-49, 2002

S. Murad, J. Lin, On Using Thin Zeolite Membranes and External Fields to Separate Supercritical Aqueous Electrolyte Solutions, Industrial & Engineering Chemistry Research, 411076-83, 2002

S. Murad, S. Gupta, Molecular Dynamics Simulation for Henry’s Constant of Oxygen in Benzene, Fluid Phase Equilibria, 1879-37, 2001

J. Lin, S. Murad, A Computer Simulation Study of the Separation of Aqueous Solutions Using Thin Zeolite Membranes, Molecular Physics, 991175-81, 2001

S. Murad, S. Gupta, A Simple Molecular Dynamics Simulation for Calculating the Henry’s Constant and Solubility of Gases in Liquids, Chemical Physics Letters, 31960-64, 2000

K. Oder, S. Murad, Molecular Simulation of Membrane Based Separations of Supercritical Electrolyte Solutions, Molecular Simulation, 25229-38, 2000

 

 

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