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Scine::Sparrow
4.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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#include "PM6DiatomicParameters.h"#include <Utils/Geometry/ElementInfo.h>#include <Utils/Geometry/ElementTypes.h>#include <Utils/Scf/MethodExceptions.h>#include <algorithm>#include <array>#include <cassert>#include <memory>

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Classes | |
| class | Scine::Sparrow::nddo::ElementPairParameters |