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Welcome to the mcmd wiki!

Click the links on the right side of the page to explore program options and functionalities.

This is a Monte Carlo / Molecular Dynamics Simulation software, mostly suited for materials-simulation. It is a work-in-progress by Douglas M. Franz @ University of South Florida with help from:
Adam Hogan, Dr. Tony Pham, Dr. Brian Space, Katherine Forrest, Brant Tudor and others.

MC Currently fully supporting NPT, NVT, NVE, uVT ensembles.

MD supporting NVT.

POLARIZATION IS NOT WORKING so avoid using potential_form ljespolar, for now.

PRE-COMPILED EXECUTABLE WORKS WITH THE FOLLOWING COMPILERS:
-> gcc compiler 6.2.0 (circe)
-> gcc compiler 4.9.3 (stampede)

To download:
git clone https://github.com/khavernathy/mcmd

To compile: (in src dir "src")
g++ main.cpp -lm -o ../t -I. -std=c++11

To run (in base dir "mcmd")
./t mcmd.inp