GCMC simulation of TraPPE CH4

use fed generic
fed method tm 600000 6000
fed order nmols 351 -0.5 350.5 1

fed done

finish

ranseed

temperature     175.0

steps  120000000 

yamldata 1000

print 2000000000
stat 2000000000

check 100000

maxmoldist 1.3
acceptmolmoveupdate 2000000001

move gcinsertmol 1 50 1.96 
ch4 0.0013

sample coords 100000

move molecules 1 30
ch4

move rotatemol 1 20
ch4

start

