Editing DL POLY
Jump to navigation
Jump to search
The edit can be undone. Please check the comparison below to verify that this is what you want to do, and then publish the changes below to finish undoing the edit.
Latest revision | Your text | ||
Line 4: | Line 4: | ||
is a general purpose serial and parallel [[molecular dynamics]] simulation package developed at Daresbury Laboratory by W. Smith, T.R. Forester and I.T. Todorov | is a general purpose serial and parallel [[molecular dynamics]] simulation package developed at Daresbury Laboratory by W. Smith, T.R. Forester and I.T. Todorov | ||
==Units== | ==Units== | ||
DL_POLY employs an interesting set of units which have molecular relevance | DL_POLY employs an interesting set of units which have molecular relevance: | ||
{| border="1" | {| border="1" | ||
|- | |- | ||
Line 70: | Line 70: | ||
**[[Gupta potential]] | **[[Gupta potential]] | ||
*External fields | *External fields | ||
==Versions of DL_POLY== | ==Versions of DL_POLY== | ||
The current version of DL_POLY is DL_POLY_4.07 | The current version of DL_POLY is DL_POLY_4.07 |