New Features of the Open Source Monte Carlo Software Brick-CFCMC: Thermodynamic Integration and Hybrid Trial Moves

H. Mert Polat, Hirad S. Salehi, Remco Hens, Dominika O. Wasik, Ahmadreza Rahbari, Frédérick De Meyer, Céline Houriez, Christophe Coquelet, Sofia Calero, David Dubbeldam, Othonas A. Moultos, Thijs J.H. Vlugt^*

^*Corresponding author for this work

Research output: Contribution to journal › Article › Scientific › peer-review

10 Citations (Scopus)

110 Downloads (Pure)

Sample simulation files for 'New Features of the Open Source Monte Carlo Software Brick-CFCMC: Thermodynamic Integration and Hybrid Trial Moves'
Polat, H. M. (Creator), Vlugt, T. J. H. (Creator), Moultos, O. (Creator), Seyed Salehi, H. (Creator), Hens, R. (Creator), Rahbari, A. (Creator), Wasik, D. O. (Creator), De Meyer, F. (Creator), Houriez, C. (Creator), Coquelet, C. (Creator), Calero, S. (Creator) & Dubbeldam, D. (Creator), TU Delft - 4TU.ResearchData, 12 May 2022
DOI: 10.4121/19738834
Dataset/Software: Dataset

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