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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3568 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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This commit is contained in:
sjplimp
2009-12-17 23:52:50 +00:00
parent f0512a96c8
commit 5f3af95136
8 changed files with 107 additions and 63 deletions
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20
src/output.cpp
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@ -137,10 +137,7 @@ void Output::setup(int flag)
if (ndump && update->restrict_output == 0) {
for (int idump = 0; idump < ndump; idump++) {
if (strcmp(dump[idump]->style,"custom") == 0 ||
strcmp(dump[idump]->style,"cfg") == 0 ||
strcmp(dump[idump]->style,"local") == 0)
modify->clearstep_compute();
if (dump[idump]->clearstep) modify->clearstep_compute();
if ((ntimestep % dump_every[idump] == 0 &&
last_dump[idump] != ntimestep) || last_dump[idump] < 0) {
dump[idump]->write();
@ -148,10 +145,7 @@ void Output::setup(int flag)
}
next_dump[idump] =
(ntimestep/dump_every[idump])*dump_every[idump] + dump_every[idump];
if (strcmp(dump[idump]->style,"custom") == 0 ||
strcmp(dump[idump]->style,"cfg") == 0 ||
strcmp(dump[idump]->style,"local") == 0)
modify->addstep_compute(next_dump[idump]);
if (dump[idump]->clearstep) modify->addstep_compute(next_dump[idump]);
if (idump) next_dump_any = MYMIN(next_dump_any,next_dump[idump]);
else next_dump_any = next_dump[0];
}
@ -208,17 +202,11 @@ void Output::write(int ntimestep)
if (next_dump_any == ntimestep) {
for (int idump = 0; idump < ndump; idump++) {
if (next_dump[idump] == ntimestep && last_dump[idump] != ntimestep) {
if (strcmp(dump[idump]->style,"custom") == 0 ||
strcmp(dump[idump]->style,"cfg") == 0 ||
strcmp(dump[idump]->style,"local") == 0)
modify->clearstep_compute();
if (dump[idump]->clearstep) modify->clearstep_compute();
dump[idump]->write();
last_dump[idump] = ntimestep;
next_dump[idump] += dump_every[idump];
if (strcmp(dump[idump]->style,"custom") == 0 ||
strcmp(dump[idump]->style,"cfg") == 0 ||
strcmp(dump[idump]->style,"local") == 0)
modify->addstep_compute(next_dump[idump]);
if (dump[idump]->clearstep) modify->addstep_compute(next_dump[idump]);
}
if (idump) next_dump_any = MYMIN(next_dump_any,next_dump[idump]);
else next_dump_any = next_dump[0];