MolecularDynamics

Project 1 on the mechanical properties of Nano Wires (under compression this time). run.sh calls the most vital LAMMPS and Python scripts that generate data files for visulization. Note that on my machine there were directories I check are empty, if you run run.sh it may complain there is no directory if so, you can make it in linux by typing: mkdir dirname. If something does not work, please contact me and I will fix it! If you want help installing LAMMPS make sure to follow the tutorial on my blog at http://rocketurtlestars.co. Thanks :)

Name		Name	Last commit message	Last commit date
Latest commit History 12 Commits
.gitattributes		.gitattributes
.gitignore		.gitignore
Brian Au Nano Wires Slides Final.pdf		Brian Au Nano Wires Slides Final.pdf
README.md		README.md
atomicNumber.sh		atomicNumber.sh
in.latticeAu.txt		in.latticeAu.txt
in.minNW001.txt		in.minNW001.txt
in.minNW011.txt		in.minNW011.txt
in.nwcompress001.txt		in.nwcompress001.txt
in.nwcompress011.txt		in.nwcompress011.txt
minnw2data001.xyz		minnw2data001.xyz
nw2data.sh		nw2data.sh
py2NW.py		py2NW.py
pyplot.py		pyplot.py
run.sh		run.sh
total_lattice.xyz		total_lattice.xyz
total_min_compress001.xyz		total_min_compress001.xyz
vmdViewNW001.xyz		vmdViewNW001.xyz
vmdViewNW011.xyz		vmdViewNW011.xyz
xyz2py.sh		xyz2py.sh
zlevel.py		zlevel.py

NightmareX20/Molecular-Dynamics-Au-Nano-Wires

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MolecularDynamics

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