eOn 3.2.0
Long-timescale dynamics: aKMC, NEB, parallel replica
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_
- r -
r :
eonc::geometry::atom
,
TinyMatrix< Type >
r_cut :
EAM::element_parameters
R_init :
eonc::AtomicGPDimer
radius :
EMT
RAList :
eonc::BondBoost
random_rotation :
eonc::metatomic_options_t
,
EonMtaConfig
,
RgpotMtaConfig
random_rotation_ :
MetatomicPotential
random_seed :
eonc::JobResultEnvelope
randomSeed :
eonc::main_options_t
ranks_per_image :
eonc::rgpot_options_t
,
RGPotEngineOptions
rate :
eonc::prefactor_options_t
,
eonc::tunneling::RateInstanton
ratio_at_limit :
eonc::gpr_dimer_options_t
raw_json :
eonc::io::ConFrameMetadata
rc_ :
EAM
,
forcefields::SpceCcl::Water
,
forcefields::Tip4p::Water
rCut2 :
NeighborList
re_ :
forcefields::Ccl
reactant :
eonc::BasinHoppingSaddleSearch
,
eonc::DynamicsSaddleSearch
,
eonc::ParallelReplicaJob
,
eonc::piqtst::Rate
,
eonc::ReplicaDynamicsJob
reactant_filename :
eonc::instanton_options_t
,
eonc::oh_tst_options_t
reactant_md_steps :
eonc::oh_tst_options_t
reactantEnergy :
eonc::BGSDObjectiveFunction
,
eonc::BiasedGradientSquaredDescent
,
eonc::MinModeSaddleSearch
,
eonc::NudgedElasticBand
realunits :
LAMMPSPot
recomputeFreeMask :
eonc::Matter
recomputeMaskedForces :
eonc::Matter
recomputePotential :
eonc::Matter
record :
eonc::ReplicaDynamicsJob::PrdClock
record_interval :
eonc::parallel_replica_options_t
,
eonc::saddle_search_options_t::dynamics_t
record_interval_input :
eonc::parallel_replica_options_t
,
eonc::saddle_search_options_t::dynamics_t
recorded_ :
eonc::pathintegral::RingPolymer
reference :
eonc::piqtst::Coordinate
referenceEnergy :
eonc::tunneling::Splitting
referencePositions :
NeighborList
refine :
eonc::optimizer_options_t
refine_transition :
eonc::parallel_replica_options_t
refineFCalls :
eonc::ReplicaDynamicsJob
registry_ :
eonc::Potential
relax_conv_angle :
eonc::gpr_dimer_options_t
relax_rotations_max :
eonc::gpr_dimer_options_t
remove_rotation :
eonc::dimer_options_t
,
eonc::saddle_search_options_t
remove_translation :
eonc::StructureComparisonOptions
removeNetForce :
eonc::main_options_t
,
eonc::Matter
replica_exchange_options_ :
eonc::Parameters::Impl
replicas :
eonc::replica_exchange_options_t
,
eonc::serve_options_t
report_level :
eonc::gpr_dimer_options_t::debug_params_t
reqFd :
LAMMPSPot
res :
XTBPot
resFd :
LAMMPSPot
resources :
AMS
,
eonc::ams_options_t
restartFrom :
AMS
restore_unhelpful :
eonc::neb::OCINEBController::Config
,
eonc::neb_options_t::climbing_image_options_t::hybrid_dimer_t
resume :
eonc::hessian_options_t
retain_climb_frames_ :
eonc::MinModeSaddleSearch
retainExchangeDir :
ExtPot
return_distances :
eonc::VesinNeighbors::Options
return_shifts :
eonc::VesinNeighbors::Options
return_vectors :
eonc::VesinNeighbors::Options
returnFiles :
eonc::BasinHoppingJob
,
eonc::GPSurrogateJob
,
eonc::NudgedElasticBandJob
,
eonc::ParallelReplicaJob
,
eonc::ProcessSearchJob
,
eonc::ReplicaDynamicsJob
,
eonc::ReplicaExchangeJob
,
eonc::SaddleSearchJob
rFermi :
EMT
rgpot_options_ :
eonc::Parameters::Impl
rh1_ :
forcefields::SpceCcl::Water
,
forcefields::Tip4p::Water
rh2_ :
forcefields::SpceCcl::Water
,
forcefields::Tip4p::Water
rhh_ :
forcefields::SpceCcl
rho :
eonc::ImprovedDimer
rigidReference :
eonc::tunneling::RateInstantonOptions
rigidRotations :
eonc::tunneling::RateInstantonOptions
rigidSqrtMasses :
eonc::tunneling::RateInstantonOptions
ring :
eonc::piqtst::RecrossingOptions
,
eonc::piqtst::ScanOptions
ringPotential :
eonc::tunneling::RateInstanton
Rm :
EAM::element_parameters
rMax :
CellList
,
NeighborList
rMax2 :
CellList
rmd_time :
eonc::hyperdynamics_options_t
rmd_time_input :
eonc::hyperdynamics_options_t
rn_ :
forcefields::Tip4p::Water
rNbCut :
EMT
rng_ :
eonc::pathintegral::RingPolymer
ro_ :
forcefields::SpceCcl::Water
,
forcefields::Tip4p::Water
roh_ :
forcefields::SpceCcl
rot_opt_method :
eonc::gpr_dimer_options_t
rotation :
eonc::IRACompare::MatchResult
rotation_angle :
eonc::dimer_options_t
,
eonc::gpr_dimer_options_t
rotation_backend :
eonc::dimer_options_t
rotationalPlane :
eonc::AtomicGPDimer
,
eonc::Dimer
rotationDidConverge :
eonc::ImprovedDimer
rotations :
eonc::DimerRotationResult
rotations_max :
eonc::dimer_options_t
rotations_min :
eonc::dimer_options_t
rotNorm :
eonc::OHTSTJob::PlaneAverages
rotRaw :
eonc::OHTSTJob::PlaneAverages
rPrev :
eonc::ImprovedDimer
runtime_ :
eonc::Job
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