On 10/12/2012 01:10 AM, Jin Chang wrote: > did the calculation as the examples (PP/examples/WorkFct_example & > dipole_example) said, but don't know why it doesn't work. Thank you again!
I have not experience with average.x but don't see something wrong in your inputs. What about the examples? Do you get the same problem, say in: PP/examples/dipole_example/results$ average.x < water.avg.in Guido -- Guido Fratesi Dipartimento di Scienza dei Materiali Universita` degli Studi di Milano-Bicocca via Cozzi 53, 20125 Milano, Italy
