source: src/Potentials/Specifics@ 96af51

Fix_FitPotential_needs_atomicnumbers
Name Size Rev Age Author Last Change
../
unittests 748fc7   11 years FrederikHeber libMolecuilder is now a shared library. - linking error …
ThreeBodyPotential_Angle.hpp 6.2 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
ThreeBodyPotential_Angle.cpp 8.6 KB 11bab4   9 years FrederikHeber Extractors now need a subgraph and the set of particle types.
PotentialTypes.undef 52 bytes a86666   13 years FrederikHeber Added PotentialTypes.
PotentialTypes.hpp 1.6 KB a86666   13 years FrederikHeber Added PotentialTypes.
PotentialTypes.def 315 bytes ff90e3   12 years FrederikHeber Renamed potential token harmonic to harmonic_bond.
PotentialTypes.cpp 1.4 KB acc9b1   12 years FrederikHeber FIX: Added new copyright lines to files in src/Potentials, too.
PairPotential_Morse.hpp 6.0 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
PairPotential_Morse.cpp 8.7 KB 11bab4   9 years FrederikHeber Extractors now need a subgraph and the set of particle types.
PairPotential_LennardJones.hpp 6.0 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
PairPotential_LennardJones.cpp 7.4 KB 11bab4   9 years FrederikHeber Extractors now need a subgraph and the set of particle types.
PairPotential_Harmonic.hpp 6.0 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
PairPotential_Harmonic.cpp 7.4 KB 11bab4   9 years FrederikHeber Extractors now need a subgraph and the set of particle types.
ManyBodyPotential_Tersoff.hpp 9.9 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
ManyBodyPotential_Tersoff.cpp 23.2 KB 11bab4   9 years FrederikHeber Extractors now need a subgraph and the set of particle types.
FourBodyPotential_Torsion.hpp 6.4 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
FourBodyPotential_Torsion.cpp 9.4 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
FourBodyPotential_Improper.hpp 2.7 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
FourBodyPotential_Improper.cpp 2.7 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
ConstantPotential.hpp 5.8 KB 0b7036   9 years FrederikHeber Added getSubgraph() to all EmpiricalPotentials. - this encodes the …
ConstantPotential.cpp 6.1 KB 11bab4   9 years FrederikHeber Extractors now need a subgraph and the set of particle types.
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