Katter's World
Thursday, May 30, 2019
Temperature drops to zero in NVT with ReaxFF
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I met this issue recently: Temperature drops to zero in NVT with ReaxFF. If you happened to meet this problem too, the following tips you c...
Monday, September 15, 2014
Change sw potential and include packages in Lammps
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Change SW potential 1. Copy file pair_sw.cpp to ./lammps/src/ folder 2. Copy file Makefile.linux to ./lammps/src/MAKE/ folder 3. Copy ...
Sunday, September 14, 2014
Some commands for linux environmental variables
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1. $ echo $SHELL 2. $ echo $PATH 3. $ setenv 4. $ vi .tcshrc 5. $ which xxx (command, such vmd, lammps...)
Thursday, September 11, 2014
commands to check cpu information on Linux
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http://www.binarytides.com/linux-cpu-information CPU hardware information The cpu information includes details about the processor, li...
Wednesday, July 10, 2013
Build Graphene with Material Studio
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Build Graphene with Material Studio 1) File -> Import -> Structures -> ceramics -> graphite.msi; 2) Build -> Symmetr...
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Wednesday, November 21, 2012
Access VirtualBox Shared Folder from Ubuntu 12.04 Guest Machine
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from: http://www.liberiangeek.net/2012/05/access-virtualbox-shared-folder-from-ubuntu-12-04-precise-pangolin-guest-machine/ Using Virtu...
Sunday, November 4, 2012
How to generate LAMMPS data file with force field parameters
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http://sunghoedwardkim.blogspot.sg/2011/04/how-to-generate-lammps-data-file-with.html To make LAMMPS data file using pdb file in VMD, 1....
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