Changes in molecuilder/src/config.cpp [f89a9e:f23d7d]

File:

• molecuilder/src/config.cpp (modified) (2 diffs, 1 prop)

molecuilder/src/config.cpp

@@ -23 +23 @@
   configpath[0]='\0';
   configname[0]='\0';
+  basis="3-21G";
   
   FastParsing = false;
@@ -1131 +1132 @@
   *output << ")" << endl;
   *output << "basis<GaussianBasisSet>: (" << endl;
-  *output << "\tname = \"3-21G\"" << endl;
+  *output << "\tname = \"" << basis << "\"" << endl;
   *output << "\tmolecule = $:molecule" << endl;
   *output << ")" << endl;