Hi all,
Recently, I had a command like that :
compute 11 all rdf 100 2 28
fix 14 all ave/time 1000 2000 2000000 c_11 file n-Cl.file mode vector
run 2000000
Then ,I had the ouput file" n-Cl.file".But in the file, there were only :
Time-averaged data for fix 14
TimeStep Number-of-rows
Row c_11[1] c_11[2] c_11[3]
I didn’t get the RDF result .
But when I did some changes in the command:
fix 14 all ave/time 1000 1000 1000000 c_11 file n-Cl.file mode vector
just change “2000 2000000” into" 1000 1000000".
Then I got the RDF result.
I feel confused about such strange problem.
Thanks.
jinhong zhou