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Long-timescale dynamics: aKMC, NEB, parallel replica
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Here is a list of all class members with links to the classes they belong to:
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_
~
- n -
n :
forcefields::Ccl::Rho
n1 :
forcefields::Ccl::Dtheta
n2 :
forcefields::Ccl::Dtheta
n_symmetry_rotations :
eonc::Parameters::metatomic_options_t
,
EonMtaConfig
,
Parameters::metatomic_options_t
,
RgpotMtaConfig
n_symmetry_rotations_ :
MetatomicPotential
n_threads :
eonc::VesinNeighbors::Options
n_vals :
eonc::Parameters::gpr_dimer_options_t::prune_params_t
,
Parameters::gpr_dimer_options_t::prune_params_t
nAllAtoms :
CellList
name :
emt_parameters
nativenv :
AMS
nAtoms :
Atoms
,
BondBoost
,
CellList
,
Dimer
,
Dynamics
,
EMT
,
eonc::BondBoost
,
eonc::Dimer
,
eonc::Dynamics
,
eonc::Matter
,
eonc::neb::ImageForceData
,
Matter
,
NeighborList
nAtomsRes :
EMT
nBAs :
BondBoost
,
eonc::BondBoost
nBBs :
BondBoost
,
eonc::BondBoost
nblist :
EMT
nc_forces_key_ :
MetatomicPotential
nCells :
CellList
neb :
eonc::NEBObjectiveFunction
,
NEBObjectiveFunction
neb_band :
eonc::io::ConFrameMetadata
neb_bead :
eonc::io::ConFrameMetadata
neb_mmf :
eonc::Parameters::debug_options_t
,
Parameters::debug_options_t
neb_options :
eonc::Parameters
,
Parameters
NEBObjectiveFunction() :
eonc::NEBObjectiveFunction
,
NEBObjectiveFunction
NEBStatus :
eonc::NudgedElasticBand
,
NudgedElasticBand
needsForceUpdate() :
eonc::Matter
,
Matter
needsPerImageInstance() :
ASE
,
ASENwchemPot
,
ASEOrcaPot
,
eonc::MetatomicDynPot
,
eonc::Potential
,
ExtPot
,
LAMMPSPot
,
MetatomicPotential
,
Potential
,
RgpotAdapter< RPot >
,
VASP
,
XTBPot
neigh_list_ :
EAM
neighbor_cutoff :
eonc::Parameters::structure_comparison_options_t
,
Parameters::structure_comparison_options_t
NeighborList() :
NeighborList
neighborList :
NeighborList
nelements :
EMT
neq :
emt_parameters
new_celllist() :
EAM
newForce :
eonc::neb::OCINEBController::MMFResult
newStateFlag :
eonc::ReplicaDynamicsJob
,
ReplicaDynamicsJob
nFreeAtoms :
eonc::neb::ImageForceData
nFreeCoords :
Dynamics
,
eonc::Dynamics
nGhosts :
GhostAtoms
nHalfNeighbors :
EMT
nImages :
Atoms
ninit :
eonc::Parameters::artn_options_t
,
Parameters::artn_options_t
nl_requests_ :
MetatomicPotential
nlmin :
eonc::GlobalOptimizationJob
,
GlobalOptimizationJob
nMax :
NeighborList
nnewchance :
eonc::Parameters::artn_options_t
,
Parameters::artn_options_t
no_overshooting :
eonc::Parameters::optimizer_options_t::cg_t
,
Parameters::optimizer_options_t::cg_t
noise_sigma2 :
eonc::Parameters::gpr_dimer_options_t::gpr_params_t
,
Parameters::gpr_dimer_options_t::gpr_params_t
non_conservative :
eonc::Parameters::metatomic_options_t
,
EonMtaConfig
,
Parameters::metatomic_options_t
non_conservative_ :
MetatomicPotential
NONE :
Dynamics
,
eonc::Dynamics
,
eonc::Hyperdynamics
,
Hyperdynamics
nonlocal_count_abort :
eonc::Parameters::saddle_search_options_t
,
Parameters::saddle_search_options_t
nonlocal_distance_abort :
eonc::Parameters::saddle_search_options_t
,
Parameters::saddle_search_options_t
nonnegative_displacement_abort :
eonc::Parameters::saddle_search_options_t
,
Parameters::saddle_search_options_t
nOperations :
eonc::IRACompare::SymmetryResult
,
IRACompare::SymmetryResult
norm() :
forcefields::PotentialBase
normalise() :
forcefields::PotentialBase
NormalizeDifference() :
Atoms
NormalizeDifferences() :
Atoms
NormalizePosition() :
Atoms
NormalizePositions() :
Atoms
NOSE_HOOVER :
Dynamics
,
eonc::Dynamics
nose_mass :
DynamicsConfig
,
eonc::DynamicsConfig
,
eonc::Parameters::thermostat_options_t
,
Parameters::thermostat_options_t
noseHooverVerlet() :
Dynamics
,
eonc::Dynamics
nperp_limitation :
eonc::Parameters::artn_options_t
,
Parameters::artn_options_t
nPlatinum() :
forcefields::ZhuPhilpott< P >
nPlatinum_ :
forcefields::ZhuPhilpott< P >
nproc :
eonc::Parameters::ase_nwchem_options_t
,
eonc::Parameters::ase_orca_options_t
,
Parameters::ase_nwchem_options_t
,
Parameters::ase_orca_options_t
nRAs :
BondBoost
,
eonc::BondBoost
nReg :
BondBoost
,
eonc::BondBoost
nSize :
EMT
,
NeighborList
nSizeRes :
EMT
nsmooth :
eonc::Parameters::artn_options_t
,
Parameters::artn_options_t
nsteps :
eonc::Parameters::neb_options_t::path_initialization_t
,
Parameters::neb_options_t::path_initialization_t
nTABs :
BondBoost
,
eonc::BondBoost
nTotalCells :
CellList
nTranslation :
Image
NudgedElasticBand() :
eonc::NudgedElasticBand
,
NudgedElasticBand
NudgedElasticBandJob() :
eonc::NudgedElasticBandJob
,
NudgedElasticBandJob
number :
Image
numberOfAtoms :
EffectiveMediumTheory
,
eonc::Matter
,
LAMMPSPot
,
Matter
numberOfFixedAtoms() :
eonc::Matter
,
Matter
numberOfFreeAtoms() :
eonc::Matter
,
Matter
numExtrema :
eonc::neb::ExtremaResult
,
eonc::NudgedElasticBand
,
NudgedElasticBand
numImages :
eonc::NudgedElasticBand
,
NudgedElasticBand
nwchem :
RGPotEngine::Impl
nwchem_settings :
eonc::Parameters::socket_nwchem_options_t
,
Parameters::socket_nwchem_options_t
,
SocketNWChemPot
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