TY - JOUR T1 - Stochastic classical molecular dynamics coupled to functional density theory: applications to large molecular systems JO - Brazilian Journal of Physics A1 - Mundim, K. C. A1 - Ellis, D. E. SN - 0103-9733 UL - 10.1590/S0103-97331999000100018 VL - 29 Y1 - 1999 PB - Brasil ER -