Sergey Kazachenko

Algorithms for GPU‐based molecular dynamics simulations of complex fluids: Applications to water, mixtures, and liquid crystals

Kyle Wm. Hall, Natalie M. Cann, N. M. Cann, 2015, J. Comput. Chem..

Water nanodroplets: predictions of five model potentials.

Sergey Kazachenko, Ajit J Thakkar, S. Kazachenko, 2013, The Journal of chemical physics.

Improved minima-hopping. TIP4P water clusters, (H2O)n with n⩽37

Ajit J. Thakkar, Sergey Kazachenko, 2009 .

Methanol clusters (CH3OH)n: putative global minimum-energy structures from model potentials and dispersion-corrected density functional theory.

Sergey Kazachenko, Ajit J Thakkar, Satya Bulusu, 2013, The Journal of chemical physics.