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Options.h File Reference
#include <stdlib.h>
#include <string>
Include dependency graph for Options.h:
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Namespaces
CheMPS2
Variables
const int
CheMPS2::DMRGSCF_maxIterations
= 100
const double
CheMPS2::DMRGSCF_gradientNormThreshold
= 1e-6
const bool
CheMPS2::DMRGSCF_storeUnitary
= true
const string
CheMPS2::DMRGSCF_unitaryStorageName
= "CheMPS2_CASSCF.h5"
const int
CheMPS2::DMRGSCF_maxlinsizeCutoff
= 100
const bool
CheMPS2::DMRGSCF_debugPrint
= false
const bool
CheMPS2::DMRGSCF_stateAveraged
= true
const int
CheMPS2::DMRGSCF_whichActiveSpace
= 0
const bool
CheMPS2::DMRGSCF_dumpCorrelations
= false
const bool
CheMPS2::DMRGSCF_startLocRandom
= false
const bool
CheMPS2::DMRGSCF_doDIIS
= false
const double
CheMPS2::DMRGSCF_DIISgradientBranch
= 1e-2
const int
CheMPS2::DMRGSCF_numDIISvecs
= 7
const bool
CheMPS2::DMRGSCF_storeDIIS
= true
const string
CheMPS2::DMRGSCF_DIISstorageName
= "CheMPS2_DIIS.h5"
const string
CheMPS2::TMPpath
= "/tmp"
const bool
CheMPS2::DMRG_printDiscardedWeight
= false
const bool
CheMPS2::DMRG_storeRenormOptrOnDisk
= true
const bool
CheMPS2::DMRG_storeMpsOnDisk
= false
const string
CheMPS2::DMRG_MPS_storage_prefix
= "CheMPS2_MPS"
const string
CheMPS2::DMRG_OPERATOR_storage_prefix
= "CheMPS2_Operators_"
const bool
CheMPS2::HAMILTONIAN_debugPrint
= false
const string
CheMPS2::HAMILTONIAN_TmatStorageName
= "CheMPS2_Ham_Tmat.h5"
const string
CheMPS2::HAMILTONIAN_VmatStorageName
= "CheMPS2_Ham_Vmat.h5"
const string
CheMPS2::HAMILTONIAN_ParentStorageName
= "CheMPS2_Ham_parent.h5"
const string
CheMPS2::TWODM_2DM_A_storagename
= "CheMPS2_2DM-A.h5"
const string
CheMPS2::TWODM_2DM_B_storagename
= "CheMPS2_2DM-B.h5"
const bool
CheMPS2::HEFF_debugPrint
= true
const int
CheMPS2::HEFF_DAVIDSON_NUM_VEC
= 32
const int
CheMPS2::HEFF_DAVIDSON_NUM_VEC_KEEP
= 3
const double
CheMPS2::HEFF_DAVIDSON_PRECOND_CUTOFF
= 1e-12
const double
CheMPS2::HEFF_DAVIDSON_RTOL_BASE
= 1e-10
const bool
CheMPS2::SYBK_debugPrint
= false
const int
CheMPS2::SYBK_dimensionCutoff
= 262144
const double
CheMPS2::TENSORT_orthoComparison
= 1e-13
const bool
CheMPS2::CORRELATIONS_debugPrint
= false
const double
CheMPS2::CORRELATIONS_discardEig
= 1e-100
const double
CheMPS2::EDMISTONRUED_gradThreshold
= 1e-8
const int
CheMPS2::EDMISTONRUED_maxIter
= 1000
const int
CheMPS2::EDMISTONRUED_maxIterBackTfo
= 15
const bool
CheMPS2::Orbopt_debugPrint
= false
extern
include
Options.h
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