moldyn / data-driven-langevin Goto Github PK
View Code? Open in Web Editor NEWProgram to run the data driven Langevin equation as described in Schaudinnus et al., Phys. Rev. Lett. 115, 050602 (2015) or Rzepiela et al. J. Chem. Phys. 141, 241102 (2014). The basic publication is Hegger and Stock, J. Chem. Phys. 130, 034106 (2009) .
License: GNU General Public License v3.0