Publications

  1. “A variational framework for spectral approximation of Kohn-Sham density functional theory”, X. Wang, T. Blesgen, K. Bhattacharya, M. Ortiz, Arch Rational Mech Anal 221: 1035 2016.
  2. “Electric field induced microstructures in thin films on physicochemically heterogeneous and patterned substrates”, S. Srivastava, P.D. S. Reddy, C. Wang, D. Bandyopadhyay, A. Sharma, J. Chem. Phys. 132, 174703, 2010.
  3. “Collective behavior during the exit of a wetting fluid through a network of channels” C.N. Baroud, X. Wang, J.B Masson, J. Colloid Interface Sci, 2008 Vol 326, 2008.
  4. “Reactive Force-field studies of large-deformation of hybrid carbon nanotube-metal nanowires”, X. Wang, R. King, M. Buehler, Materials Research Symposium Proceedings, 963; 273-278, 2007.

Manuscripts in preparation

  1. "Robust Chebyshev filtering for self-consistent field iterations", A. Breuer, X. Wang.
  2. "Lanczos subspace iteration for self-consistent field iterations", X. Wang, K. Leiter, A. Breuer, J. Knap.

Recent conferences and workshops

  1. Workshop on computational modeling of nanoscale phenomena, Ann Arbor, Michigan, 2016.
  2. Argonne training program on extreme scale computing, St. Charles, Illinois, 2016.
  3. "Lanczos-filter for self-consistent field iterations", Siam conference on mathematical aspects of materials science, Philadelphia, Pennsylvania, 2016.
  4. "Lanczos-filter for self-consistent field iterations", 14th copper mountain conference on iterative methods, Copper Mountain, Colorado, 2016.
  5. “Generalized spectral quadrature method for Kohn-Sham density functional theory”, The 52nd technical meeting for the society of engineering science, College Station, Texas, 2015.