Hi dear all
for calculation The caloric curve ( potential energy v.s temperature )
by lampps what command need to use ?
best
Ehsan
Hi dear all
for calculation The caloric curve ( potential energy v.s temperature )
by lampps what command need to use ?
best
Ehsan
First: read the manual. Carefully.
Second: use many commands, to "compute" the "pe", the "temp", to output
("thermo") the results, etc...