| # | Line 79 | Line 79 | namespace OpenMD { | |
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| 79 | RealType* rij; /**< interatomic separation */ | |
| 80 | RealType* r2; /**< square of rij */ | |
| 81 | RealType* rcut; /**< cutoff radius for this interaction */ | |
| 82 | + | bool shiftedPot; /**< shift the potential up inside the cutoff? */ |
| 83 | + | bool shiftedForce; /**< shifted forces smoothly inside the cutoff? */ |
| 84 | RealType* sw; /**< switching function value at rij */ | |
| 85 | int* topoDist; /**< topological distance between atoms */ | |
| 86 | RealType* vdwMult; /**< multiplier for van der Waals interactions */ | |
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