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fixed issues with several input scripts, added reference log files

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This commit is contained in:
Trung Nguyen
2025-03-11 16:10:04 -05:00
parent 4246fab500
commit 0004a384fe
10 changed files with 677 additions and 7 deletions
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2
examples/rerun/in.rdf.first
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@ -27,7 +27,7 @@ neigh_modify delay 0 every 20 check no
fix 1 all nve
dump 1 all custom 100 lj.dump id type x y z
dump 1 all custom 100 lj.dump id type x y z vx vy vz
compute myRDF all rdf 50 cutoff 2.5
fix 2 all ave/time 100 10 1000 c_myRDF[*] file rdf.first mode vector