Added elastic constant example at finite temperature

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14099 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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athomps
2015-10-05 18:30:11 +00:00
parent eda7896364
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# Compute elastic constant tensor for a crystal at finite temperature
#
# WARNING: This script attempts to measure small differences in
# statistical averages generated by finite temperature MD simulations.
# This creates many more opportunities for errors to occur, compared
# to the zero temperature version provided in examples/ELASTIC.
# Hence, it is always a good idea to start with the zero temperature
# calculation, before attempting to use this script.
#
# Written by Aidan Thompson (Sandia, athomps@sandia.gov)
#
# This script uses the following three include files.