| 46 |
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#include "nonbonded/NonBondedInteraction.hpp" |
| 47 |
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#include "UseTheForce/ForceField.hpp" |
| 48 |
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#include "math/CubicSpline.hpp" |
| 49 |
+ |
#include "types/SuttonChenAdapter.hpp" |
| 50 |
|
|
| 51 |
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namespace OpenMD { |
| 52 |
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| 86 |
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| 87 |
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private: |
| 88 |
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void initialize(); |
| 88 |
– |
SCParam getSCParam(AtomType* atomType); |
| 89 |
– |
RealType getC(AtomType* atomType); |
| 90 |
– |
RealType getM(AtomType* atomType); |
| 91 |
– |
RealType getN(AtomType* atomType); |
| 92 |
– |
RealType getAlpha(AtomType* atomType); |
| 93 |
– |
RealType getEpsilon(AtomType* atomType); |
| 89 |
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RealType getAlpha(AtomType* atomType1, AtomType* atomType2); |
| 90 |
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RealType getEpsilon(AtomType* atomType1, AtomType* atomType2); |
| 91 |
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RealType getM(AtomType* atomType1, AtomType* atomType2); |