IPotential
IPotential0MoleculeLrc
, IPotentialMolecularSecondDerivative
, IPotentialMolecularTorque
, PotentialMolecularSoft
EwaldSumMolecules
, P0LatticeEnergyCorrec
, P1ExternalField
, P22CLJmuQ
, P22CLJQ
, P2AceticAcidTwoSite
, P2CO2EMP
, P2CO2EMP1
, P2CO2EMP2
, P2CO2TraPPE
, P2DLPOLY
, P2HardAssociationGCPMReference
, P2HardAssociationRefAceticAcidTwoSite
, P2HSDipole
, P2HSPolymer
, P2HydrogenHinde.P2HydrogenHindeMolecular
, P2HydrogenPatkowski.P2HydrogenPatkowskiMolecular
, P2LJDipole
, P2LJDipole
, P2MoleculeMonatomic
, P2MoleculeSoftTruncatedSwitched
, P2MoleculeTruncated
, P2Nitrogen
, P2NitrogenAB
, P2NitrogenAnisotropic
, P2NitrogenShellModel
, P2QChem
, P2ReactionFieldDipole
, P2ReactionFieldDipoleTruncated
, P2ReactionFieldDipoleTruncated.P0ReactionField
, P2SemiclassicalMolecular
, P2Water3P
, P2Water3PSoft
, P2Water4P
, P2Water4PSoft
, P2WaterSPC
, P2WaterSPCE
, P2WaterSPCSoft
, P2WaterTIP4P
, P2WaterTIP4PHardCore
, P2WaterTIP4PSoft
, P3HydrogenGarberoglioMolecular
, P3HydrogenManzhos.P3HydrogenManzhosMolecular
, PNCO2GCPM
, PNCO2GCPM.P3GCPMAxilrodTeller
, PNGCPM
, PNGCPM.P3GCPMAxilrodTeller
, PNGCPM.PNGCPMCached
, PNGCPMX
, PNWaterGCPM
, PNWaterGCPM.PNWaterGCPMCached
, PNWaterGCPMReactionField
, PNWaterGCPMThreeSite
, PotentialDLPOLY
, PotentialEmul
, PotentialEmulCached
, PotentialGroup
, PotentialGroup3PI
, PotentialGroup3PI.PotentialGroup3PISkip
, PotentialGroupHybrid
, PotentialGroupNbr
, PotentialGroupPI
, PotentialGroupPI.PotentialGroupPISkip
, PotentialGroupSoft
, PotentialMolecular
, PotentialMolecularMonatomic
, PotentialMolecularSum
, PotentialNonAdditive
, PotentialNonAdditive.PotentialNonAdditiveNB
, PotentialNonAdditiveDifference
, PRotConstraint
, VirialB2WaterTIP4P_DHS_difference.P2WaterDHS
public interface IPotentialMolecular extends IPotential
Modifier and Type | Method | Description |
---|---|---|
double |
energy(IMoleculeList molecules) |
Returns the interaction energy between the given atoms.
|
getRange, nBody, setBox
double energy(IMoleculeList molecules)