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better documention and error checking for 2d general triclinic

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Steve Plimpton
2024-04-08 10:43:20 -06:00
parent 1a019889f2
commit c2b91ccc8a
10 changed files with 170 additions and 95 deletions
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2
src/read_data.cpp
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@ -1394,7 +1394,7 @@ void ReadData::header(int firstpass)
if (addflag == NONE) atom->nimpropertypes = nimpropertypes + extra_improper_types;
// these settings only used by first data file
// NOTEL these are now obsolete, we parse them to maintain backward compatibility
// NOTE: these are now obsolete, we parse them to maintain backward compatibility
// the recommended way is to set them via command keywords in the input script
// if these flags are set both ways, the larger of the two values is used