Recent Publications

B. Kim and X. Song,Calculations of the Second Virial Coefficients of Protein Solutions with an Extended Fast Multipole Method, Phys. Rev. E 83, 011915(2011). [PDF]

S. Bose, R. Adhikary, C. Barnes, D. Fulton, M. Hargrove, X. Song and J. W. Petrich, Comparison of the Dielectric Response Obtained from Fluorescence Upconversion Measurements and Molecular Dynamics Simulations for Coumarin 153-Apomyoglobin Complexes and Structural Analysis of the Complexes by NMR and Fluorescence Methods, J. Phys. Chem. A 115, 3630(2011). [PDF]

T. Xiao and X. Song, A molecular Debye-Huckel theory and its applications to electrolyte solutions, J. Chem. Phys. 135, 104104(2011).[PDF]

V.B. Warshavsky and X. Song, Perturbation theory of solid-liquid interfacial free energies of bcc metals, Phys. Rev. E, 86,031602 (2012). [PDF]

T. Xiao and X. Song, Reorganization energy of electron transfer processes in ionic fluids:a molecular Debye-Huckel approach , J. Chem. Phys., 138,114105 (2013). [PDF] 


T. Xiao and X. Song, A molecular Debye-Huckel approach to the reorganization energy of electron transfer reactions in an electric cell,  J. Chem. Phys., 141,134104(2014). PDF


K. G. S. H. Gunawardana, S. R. Wilson, and M. I. Mendelev and X. Song, Theoretical calculation of the melting curve of Cu-Zr alloys, Phys. Rev. E, 90, 052403(2014). PDF


K. G. S. H. Gunawardana and X. Song, Free Energy Calculations of Crystalline Hard Sphere Complexes Using Density Functional Theory, J.Phys. Chem. B,119,9160(2015). PDF


K. Santra, J. Zhan, X. Song, E. A. Smith, N. Vaswani and J. W. Petrich, What Is the Best Method to Fit Time-Resolved Data? A Comparison of the Residual Minimization and the Maximum Likelihood Techniques As Applied to Experimental Time-Correlated, Single-Photon Counting Data, J. Phys. Chem. B, 120, 2484(2016). [PDF]


K. Santra, E.A. Smith, J.W. Petrich, and X. Song, Photon Counting Data Analysis: Application of the Maximum Likelihood and Related Methods for the Determination of Lifetimes in Mixtures of Rose Bengal and Rhodamine B, J. Phys. Chem. A, 121, 122(2017).[PDF]


T. Xiao and X. Song, A molecular Debye-H¨uckel theory and its applications to electrolyte solutions: The size asymmetric case.,  J. Chem. Phys.,146,124118 (2017). PDF


Full Publications List