Changeset fdd789 for src/FunctionApproximation/FunctionArgument.cpp

Timestamp:

Oct 3, 2016, 6:03:21 PM (9 years ago)

Author:

Frederik Heber <heber@…>

Branches:

Fix_FitPotential_needs_atomicnumbers

Children:

fc08c7

Parents:

36f3d3

Message:

Added bonded flag to argument_t.

File:

• src/FunctionApproximation/FunctionArgument.cpp (modified) (1 diff)

src/FunctionApproximation/FunctionArgument.cpp

@@ -45 +45 @@
   ost << "[(" << arg.indices.first << "," << arg.indices.second
       << "), q(   " << arg.types.first << "," << arg.types.second << "),"
+      << "bonded(" << (arg.bonded ? "true" : "false") << "),"
       << "r=" << arg.distance;
   return ost;