Analysis |
nMOLDYN internal name |
Section |
Mean-Square Displacement |
MeanSquareDisplacement_serial |
4.2.4.1 |
Root Mean-Square Deviation |
RootMeanSquareDeviation_serial |
4.2.4.2 |
Radius of gyration |
RadiusOfGyration_serial |
4.2.4.3 |
Angular Correlation |
AngularCorrelation_serial |
4.2.4.4 |
Velocity Autocorrelation Function |
CartesianVelocityAutoCorrelationFunction_serial |
4.2.4.5 |
Density Of States |
CartesianDensityOfStates_serial |
4.2.4.6 |
Pass-Band Filtered Trajectory |
PassBandFilteredTrajectory_serial |
4.2.4.7 |
Global Motion Filtered Trajectory |
GlobalMotionFilteredTrajectory_serial |
4.2.4.8 |
Rigid-Body Trajectory |
RigidBodyTrajectory_serial |
4.2.4.9 |
Center Of Mass Trajectory |
CenterOfMassTrajectory_serial |
4.2.4.10 |
Auto-Regressive Analysis |
AutoRegressiveAnalysis_serial |
4.2.4.11 |
Quasi Harmonic Analysis |
QuasiHarmonicAnalysis_serial |
4.2.4.12 |
Reorientational Correlation Function |
ReorientationalCorrelationFunction_serial |
4.2.4.13 |
Angular Velocity AutoCorrelation Function |
AngularVelocityAutoCorrelationFunction_serial |
4.2.4.14 |
Angular Density Of States |
AngularDensityOfStates_serial |
4.2.4.15 |
Dynamic Coherent Structure Factor |
DynamicCoherentStructureFactor_serial |
4.2.5.2 |
Dynamic Coherent Structure Factor (AR Model) |
DynamicCoherentStructureFactorAR_serial |
4.2.5.3 |
Dynamic Incoherent Structure Factor |
DynamicIncoherentStructureFactor_serial |
4.2.5.4 |
Dynamic Incoherent Structure Factor (AR Model) |
DynamicIncoherentStructureFactorAR_serial |
4.2.5.5 |
Dynamic Incoherent Structure Factor (Gaussian Approximation) |
DynamicIncoherentStructureFactorGaussian_serial |
4.2.5.6 |
Elastic Incoherent Structure Factor |
ElasticIncoherentStructureFactor_serial |
4.2.5.7 |
Static Coherent Structure Factor |
StaticCoherentStructureFactor_serial |
4.2.5.8 |
Smoothed Static Coherent Structure Factor |
SmoothedStaticCoherentStructureFactor_serial |
4.2.5.9 |
Pair Distribution Function |
PairDistributionFunction_serial |
4.2.6.1 |
Coordination number |
CoordinationNumber_serial |
4.2.6.2 |
Spatial Density |
SpatialDensity_serial |
4.2.6.3 |
ScrewFit analysis |
ScrewFitAnalysis_serial |
4.2.6.4 |
Order Parameter |
OrderParameter_serial |
4.2.7.1 |
Order Parameter (Contact Model) |
OrderParameterContactModel_serial |
4.2.7.2 |