Implementation of replica-exchange umbrella sampling in the DFTB[formula omitted] semiempirical quantum chemistry package.

MLA

Ito, Shingo, et al. “Implementation of Replica-Exchange Umbrella Sampling in the DFTB[Formula Omitted] Semiempirical Quantum Chemistry Package.” Computer Physics Communications, vol. 204, July 2016, pp. 1–10. EBSCOhost, https://doi.org/10.1016/j.cpc.2016.02.010.

APA

Ito, S., Irle, S., & Okamoto, Y. (2016). Implementation of replica-exchange umbrella sampling in the DFTB[formula omitted] semiempirical quantum chemistry package. Computer Physics Communications, 204, 1–10. https://doi.org/10.1016/j.cpc.2016.02.010

Chicago

Ito, Shingo, Stephan Irle, and Yuko Okamoto. 2016. “Implementation of Replica-Exchange Umbrella Sampling in the DFTB[Formula Omitted] Semiempirical Quantum Chemistry Package.” Computer Physics Communications 204 (July): 1–10. doi:10.1016/j.cpc.2016.02.010.