OpenFOAM: API Guide
v2112
The open source CFD toolbox
molecularDynamics → OpenFOAM Relation
File in src/lagrangian/molecularDynamics
Includes file in src/OpenFOAM
potential
/
pairPotential
/
derived
/
azizChen
/
azizChen.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
molecularMeasurements
/
bufferedAccumulator
/
bufferedAccumulator.H
fields
/
Fields
/
Field
/
Field.H
molecularMeasurements
/
bufferedAccumulator
/
bufferedAccumulatorIO.C
db
/
IOstreams
/
IOstreams.H
molecularMeasurements
/
correlationFunction
/
correlationFunction.H
db
/
dictionary
/
dictionary.H
molecularMeasurements
/
correlationFunction
/
correlationFunctionIO.C
db
/
IOstreams
/
IOstreams.H
potential
/
pairPotential
/
derived
/
coulomb
/
coulomb.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
pairPotential
/
derived
/
coulomb
/
coulomb.C
global
/
constants
/
mathematical
/
mathematicalConstants.H
potential
/
pairPotential
/
derived
/
dampedCoulomb
/
dampedCoulomb.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
pairPotential
/
derived
/
dampedCoulomb
/
dampedCoulomb.C
global
/
constants
/
mathematical
/
mathematicalConstants.H
molecularMeasurements
/
distribution
/
distribution.C
db
/
IOstreams
/
Fstreams
/
OFstream.H
molecularMeasurements
/
distribution
/
distribution.H
containers
/
HashTables
/
Map
/
Map.H
molecularMeasurements
/
distribution
/
distribution.H
primitives
/
Pair
/
Pair.H
potential
/
energyScalingFunction
/
derived
/
doubleSigmoid
/
doubleSigmoid.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
electrostaticPotential
/
electrostaticPotential.C
global
/
constants
/
mathematical
/
mathematicalConstants.H
potential
/
electrostaticPotential
/
electrostaticPotential.H
primitives
/
Scalar
/
scalar
/
scalar.H
potential
/
energyScalingFunction
/
basic
/
energyScalingFunction.H
memory
/
autoPtr
/
autoPtr.H
potential
/
energyScalingFunction
/
basic
/
energyScalingFunction.H
db
/
IOobjects
/
IOdictionary
/
IOdictionary.H
potential
/
energyScalingFunction
/
basic
/
energyScalingFunction.H
db
/
runTimeSelection
/
construction
/
runTimeSelectionTables.H
potential
/
energyScalingFunction
/
basic
/
energyScalingFunction.H
db
/
typeInfo
/
typeInfo.H
potential
/
pairPotential
/
derived
/
exponentialRepulsion
/
exponentialRepulsion.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
tetherPotential
/
derived
/
harmonicSpring
/
harmonicSpring.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
pairPotential
/
derived
/
lennardJones
/
lennardJones.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
pairPotential
/
derived
/
maitlandSmith
/
maitlandSmith.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
pairPotential
/
basic
/
pairPotential.H
memory
/
autoPtr
/
autoPtr.H
potential
/
pairPotential
/
basic
/
pairPotential.H
db
/
IOobjects
/
IOdictionary
/
IOdictionary.H
potential
/
pairPotential
/
basic
/
pairPotential.H
containers
/
Lists
/
List
/
List.H
potential
/
pairPotential
/
basic
/
pairPotential.H
primitives
/
Pair
/
Pair.H
potential
/
pairPotential
/
basic
/
pairPotential.H
db
/
runTimeSelection
/
construction
/
runTimeSelectionTables.H
potential
/
pairPotential
/
basic
/
pairPotential.H
primitives
/
bools
/
Switch
/
Switch.H
potential
/
pairPotential
/
basic
/
pairPotential.H
db
/
typeInfo
/
typeInfo.H
potential
/
pairPotential
/
basic
/
pairPotentialIO.C
db
/
IOstreams
/
IOstreams.H
potential
/
tetherPotential
/
basic
/
tetherPotential.H
memory
/
autoPtr
/
autoPtr.H
potential
/
tetherPotential
/
basic
/
tetherPotential.H
db
/
IOobjects
/
IOdictionary
/
IOdictionary.H
potential
/
tetherPotential
/
basic
/
tetherPotential.H
db
/
runTimeSelection
/
construction
/
runTimeSelectionTables.H
potential
/
tetherPotential
/
basic
/
tetherPotential.H
db
/
typeInfo
/
typeInfo.H
potential
/
tetherPotential
/
basic
/
tetherPotential.H
primitives
/
Vector
/
vector
/
vector.H
molecule
/
molecule
/
molecule.C
primitives
/
random
/
Random
/
Random.H
molecule
/
molecule
/
molecule.C
db
/
Time
/
Time.H
molecule
/
molecule
/
molecule.H
db
/
IOstreams
/
IOstreams
/
IOstream.H
molecule
/
molecule
/
molecule.H
memory
/
autoPtr
/
autoPtr.H
molecule
/
molecule
/
molecule.H
primitives
/
DiagTensor
/
diagTensor
/
diagTensor.H
molecule
/
molecule
/
moleculeIO.C
db
/
IOstreams
/
IOstreams.H
molecule
/
moleculeCloud
/
moleculeCloud.C
global
/
unitConversion
/
unitConversion.H
molecule
/
moleculeCloud
/
moleculeCloud.H
db
/
IOobjects
/
IOdictionary
/
IOdictionary.H
molecule
/
moleculeCloud
/
moleculeCloud.H
primitives
/
Vector
/
labelVector
/
labelVector.H
molecule
/
moleculeCloud
/
moleculeCloud.H
primitives
/
random
/
Random
/
Random.H
molecule
/
moleculeCloud
/
moleculeCloud.H
primitives
/
strings
/
fileName
/
fileName.H
molecule
/
moleculeCloud
/
moleculeCloudI.H
global
/
constants
/
constants.H
potential
/
pairPotential
/
derived
/
noInteraction
/
noInteraction.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
energyScalingFunction
/
derived
/
noScaling
/
noScaling.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
pairPotential
/
pairPotentialList
/
pairPotentialList.C
db
/
IOstreams
/
Fstreams
/
OFstream.H
potential
/
pairPotential
/
pairPotentialList
/
pairPotentialList.C
db
/
Time
/
Time.H
potential
/
pairPotential
/
pairPotentialList
/
pairPotentialList.H
containers
/
PtrLists
/
PtrList
/
PtrList.H
potential
/
pairPotential
/
pairPotentialList
/
pairPotentialList.H
primitives
/
strings
/
word
/
word.H
potential
/
pairPotential
/
pairPotentialList
/
pairPotentialList.H
meshes
/
polyMesh
/
polyMesh.H
potential
/
tetherPotential
/
derived
/
pitchForkRing
/
pitchForkRing.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
potential
/
potential.H
meshes
/
polyMesh
/
polyMesh.H
potential
/
potential
/
potential.H
db
/
IOobjects
/
IOdictionary
/
IOdictionary.H
potential
/
potential
/
potential.H
db
/
Time
/
Time.H
molecule
/
reducedUnits
/
reducedUnits.H
primitives
/
Scalar
/
scalar
/
scalar.H
molecule
/
reducedUnits
/
reducedUnits.H
db
/
IOobjects
/
IOdictionary
/
IOdictionary.H
molecule
/
reducedUnits
/
reducedUnitsIO.C
db
/
IOstreams
/
IOstreams.H
potential
/
tetherPotential
/
derived
/
restrainedHarmonicSpring
/
restrainedHarmonicSpring.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
energyScalingFunction
/
derived
/
shifted
/
shifted.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
energyScalingFunction
/
derived
/
shiftedForce
/
shiftedForce.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
energyScalingFunction
/
derived
/
sigmoid
/
sigmoid.C
db
/
runTimeSelection
/
construction
/
addToRunTimeSelectionTable.H
potential
/
tetherPotential
/
tetherPotentialList
/
tetherPotentialList.H
containers
/
Lists
/
ListOps
/
ListOps.H
potential
/
tetherPotential
/
tetherPotentialList
/
tetherPotentialList.H
containers
/
PtrLists
/
PtrList
/
PtrList.H
potential
/
tetherPotential
/
tetherPotentialList
/
tetherPotentialList.H
primitives
/
strings
/
word
/
word.H
src
lagrangian
molecularDynamics
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