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Merge pull request #1068 from mlestep/oeprop-printing

Oeprop printing
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loriab committed Jul 4, 2018
2 parents 72c30b5 + b6dd8b4 commit e8fe8e3d50dc62d7330d31257b96d66032374620
Showing with 6 additions and 1 deletion.
  1. +6 −1 psi4/src/psi4/libmints/oeprop.cc
@@ -863,7 +863,12 @@ bool from_string(T& t,
void OEProp::compute()
{
outfile->Printf( "\nProperties computed using the %s density matrix\n\n", title_.c_str());
if (title_ == "") {
outfile->Printf("OEProp: No title given, name of density matrix used for the following properties is '%s'\n", Da_so_->name().c_str());
} else {
outfile->Printf( "\nProperties computed using the %s density matrix\n\n", title_.c_str());
}
// Search for multipole strings, which are handled separately
std::set<std::string>::const_iterator iter = tasks_.begin();

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