School of Engineering at the University of Edinburgh

Lev Sarkisov Group Web Page

   

     

 

 

 

Publications

2011

  • "Computational structure characterisation tools in application to ordered and disordered porous materials", L. Sarkisov and A. Harrsion, Molecular Simulation, (2011) [view]

  • "Molecular Recognition Effects in Atomistic Models of Imprinted Polymers" E. M. A. Dourado, C. Herdes, P. R. Van Tassel and L. Sarkisov, Int. J. Mol. Sci., Issue 12(8), Pages 4781-4804, (2011) [view]

  • "Structure and Phase Transformations of DPPC Lipid Bilayers in the Presence of Nanoparticles: Insights from Coarse-Grained Molecular Dynamics Simulations", J. P. Prates Ramalho, P. Gkeka, L. Sarkisov, Langmuir, Issue 27 (7), Pages 3723–3730 (2011) [view]

  • "Towards predictive molecular simulations of normal and branched alkane adsorption in carbonaceous engine deposits" J. M.C. Pinto da Costa, R. F. Cracknell, N. A. Seaton, L. Sarkisov, Carbon, Volume 49, Issue 2, Pages 445-456 (2011) [view]

2010

  • "Interactions of Phospholipid Bilayers with Several Classes of Amphiphilic alpha-Helical Peptides: Insights from Coarse-Grained Molecular Dynamics Simulations" P. Gkeka and L. Sarkisov, J. Phys. Chem. B, 114 (2)   Pages: 826-839 (2010) [view]

2009

  • “Structural Characterization of Carbonaceous Combustion-Chamber Deposits” , Pinto da Costa, J. M. C., Cracknell, R. F., Sarkisov, L., and Seaton, N. A.,Carbon, 47, 3322 (2009)[view]
  • “Emergence of molecular recognition phenomena in a simple model of imprinted porous materials, E. M. A. Dourado and L. Sarkisov, J. Chem. Phys. 2009, 130(21), 214701 [view]
  • "Computer simulation of VOCs adsorption in atomistic models of molecularly imprinted polymers". C. Herdes and L. Sarkisov, Langmuir 25(9), pp. 5352-5359 (2009) [view]
  • "Computer simulation of adsorption in simple models of molecularly imprinted polymers", E. M. A. Dourado and L. Sarkisov, MODELING AND SIMULATION OF NEW MATERIALS: Proceedings of Modeling and Simulation of New Materials: Tenth Granada Lectures, 1091, pp. 256-261(2009) [view]
  • "Adsorption-based Structural Characterization of Combustion Chamber Deposits", J. M. C. Pinto da Costa, R. F. Cracknell, L. Sarkisov and N. A. Seaton, SAE World Congress & Exhibition, 2009-01-0502 (2009) [view]
  • "Spontaneous Formation of a Barrel-Stave Pore in a Coarse-Grained Model of the Synthetic LS3 Peptide and a DPPC Lipid Bilayer", P. Gkeka and L. Sarkisov, The Journal of Physical Chemistry B, 113, pp. 6-8 (2009) [view]
  • COMPUTER SIMULATION OF ENANTIOSELECTIVE ADSORPTION IN A SIMPLE MODEL OF MOLECULARLY IMPRINTED POLYMERS. R. Sporl and L. Sarkisov, CHARACTERIZATION OF POROUS SOLIDS VIII, 2009. [view]

2008

  • "Molecular Dynamics Characterization of Protein Crystal Contacts in Aqueous Solutions", G. Pellicane, G. Smith, L. Sarkisov, Phys. Rev. Lett., 101, 248102 (2008) [view]
  • "Theories of molecular fluids confined in disordered porous materials", L. Sarkisov and P.R. Van Tassel, J. Physics: Condensed Matter, 20, 333101 (2008) [view]
  • Theory of pair connectedness in templated quenched-annealed systems”, L. Sarkisov, J. Chem. Phys. 128, 044707 (2008) [view]

2007

  • “Integral Equation Theory of Adsorption in Templated Materials: Influence of Molecular Attraction”,  L. Sarkisov and P R. Van Tassel, J. Phys. Chem. C, 111(43), 15726 (2007) [view]
  • “Solution-Phase Structural Characterization of Supramolecular Assemblies by Molecular Diffraction”, J. L. O'Donnell, X. Zuo, A. J. Goshe,  L. Sarkisov, R. Q. Snurr, J. T. Hupp, D. M. Tiede,  J. Am. Chem. Soc., 129(6), 1578 (2007) [view]

2006

  • “The role of diffusion in applications of novel nanoporous materials and novel uses of traditional materials”, L. Sarkisov, K. Czaplewski and R. Q. Snurr, NATO ASI series on the Fluid Transport in Nanoporous Materials (2006) [Book chapter]
  • “Molecular squares, rectangles and corners: Ground-state electronic structure and configurational properties”, D.E. Ellis, L. Miljacic, B. Deng, M. Jiang, L. Sarkisov, R. Q. Snurr, Chemistry of Materials 18(3), 620-628 (2006) [view]

2005

  • “Replica Ornstein-Zernike theory of adsorption in a templated porous material: interaction site systems”, L. Sarkisov and P. R. Van Tassel (2005). Journal of Chemical Physics, 123(16) (2005) [view]

2004

  • “Structural Analysis of Porphyrin Molecular Squares using Molecular Mechanics and Density Functional Methods”, L. Miljacic, L. Sarkisov, D. E. Ellis, and R. Q. Snurr., Journal of Chemical Physics, 121(15), 7228 (2004) [view]
  • “Design of new materials for methane storage”, T. Düren, L. Sarkisov, R. Q. Snurr and O. M. Yaghi, Langmuir 20, 2683 (2004) [view]
  • “The role of diffusion in applications of novel nanoporous materials and novel uses of traditional materials”, L. Sarkisov, K. Czaplewski and R. Q. Snurr, NATO ASI series on the Fluid Transport in Nanoporous Materials (2004)
  • “Molecular modelling of adsorption in novel nanoporous metal-organic materials”, L. Sarkisov, T. Düren, and R. Q. Snurr, Molecular Physics 102(4), 211 (2004) [view]

Previous Publications      

  • "Understanding adsorption hysteresis in porous glasses and other mesoporous materials", H.-J. Woo, L. Sarkisov, P.A. Monson, Characterization of porous solids VI ; Studies in surface science and catalysis, 144, 155 (2002)
  • "A lattice model of adsorption and hysteresis in disordered porous materials: Monte Carlo simulations and Mean Field Theory", L. Sarkisov and P. A. Monson, Phys.Rev. E, 65, 011202(2002) [view]
  • "Mean-field theory of fluid adsorption in porous glass", H.-J. Woo, L. Sarkisov and P. Monson, Langmuir 17, 7472 (2001) [view]
  • "Molecular Dynamics simulation of adsorption in pores of a simple geometry", L. Sarkisov and P. A. Monson, Langmuir, 17, 7600 (2001) [view]
  • "Capillary condensation in disordered porous materials: hysteresis versus equilibrium behavior", E. Kierlik, P. Monson, M. L. Rosinberg, L. Sarkisov and G. Tarjus, Phys. Rev. Lett., 87 (5), 055701 (2001) [view]
  • "Hysteresis in Monte Carlo and Molecular Dynamics Simulations of Adsorption in Porous Materials", L. Sarkisov and P. A. Monson. Langmuir, 16, 9857 (2000) [view]
  • "Computer simulations of phase equilibrium for a fluid confined in a disordered porous structure", L. Sarkisov and P. A. Monson, Phys. Rev. E, 61, 7231 (2000) [view]
  • "Capillary condensation and hysteresis in disordered porous materials", L. Sarkisov and P. A. Monson, Stud. Surf. Sci. Catalysis, 128, 21 (2000)
  • "Molecular modeling of fluid phase equilibrium in disordered porous materials". L. Sarkisov, K. S. Page and P. A. Monson, Fundamentals of Adsorption, F. Meunier (editor), 6, 847 (1998)
  • "Mass spectral determination of activities of nonvolatile components of chromium silicides and carbides". A. S. Alikhanyan, K. N. Marushkin, K. L. Kosyrev, L. G. Sarkisov, and S. E. Olsen. Doclady Physical Chemistry, 352, 201 (1997)