ergo
Class List
Here are the classes, structs, unions and interfaces with brief descriptions:
[detail level 123]
oN@0
oNCI
oNDft
oNDM
oNJK
oNLR
oNmat
oNper
oNSCF
oCabalpha_struct
oCabcd_struct
oCActiveBfShellsA class that is able to quickly determine the active shells that overlap with given box in space
oCAtomSimple atom representation by its charge and cartesian coordinates
oCatom_box_struct
oCAtomicGrid
oCBall
oCbasis_func_group_info_for_box
oCbasis_func_index_pair_struct
oCbasis_func_index_pair_struct_1el
oCbasis_func_pair_struct
oCbasis_func_poly_struct
oCbasis_func_term_struct
oCbasis_set_range_struct
oCbasisFuncGroupPairStruct
oCBasisFuncStruct_
oCBasisInfoStruct
oCbasisset_atom_struct
oCbasisset_shell_struct
oCbasisset_struct
oCBasissetNameRange
oCBoxClass Box provides an ability to determine box containing all Objects
oCbox_item_struct
oCbox_level_struct
oCbox_struct
oCbox_struct_basic
oCBoxPartitioner"Block" partitioning is the only one implemented now..
oCBoxStruct_
oCBoxSystem
oCBoysFuncIntervalStruct
oCchunk_struct
oCcluster_struct
oCCompareClass
oCComplexMatrix
oCcompute_grid_for_box_params_struct
oCcompute_grid_thread_func_struct
oCComputeGridResultValuesStruct
oCcontrib_debug_struct
oCCSR_element_struct
oCcsr_index_pair_struct
oCcsr_matrix_row_struct
oCcsr_matrix_struct
oCDensfitData
oCdensityFileHeaderStruct
oCDensitySpecStruct
oCDftGridReader
oCDftIntegratorBl_
oCDIISManager
oCDIISManagerRestricted
oCDIISManagerUnrestricted
oCdistr_group_struct
oCdistr_idxs_and_factor_struct
oCdistr_list_description_struct
oCdistr_org_struct
oCDistributionSpecStruct_
oCDistributionSpecStructLabeled
oCDistributionSpecStructWithPairIdx
oCdmatElementStruct
oCErgoAn object representing the state of the input processor
oCergo_barrier
oCErgoE2EvaluatorErgoE2Evaluator implements the linear tranformation of the trial vector/transition density matrix by the E[2] operator
oCErgoGridStreamErgo-specific GridStream implementation
oCErgoMolInfoErgo specific implementation of molecule-grid interface
oCErgoOperator
oCExponentList
oCexpRule
oCFCAccumulator
oCFileMatrix
oCFirstDrvA vector of first order derivatives with respect to two parameters: density rho and SQUARE of the gradient of density grho
oCfour_idx_AO_struct
oCfour_idx_SO_struct
oCFullMatrixWrapper
oCFuncList_
oCFunctional_
oCFunctionalList
oCFunDensProp_
oCFunFirstFuncDrv
oCFunFourthFuncDrv
oCFunSecondFuncDrv
oCFunThirdFuncDrv
oCGridGenerationParamsStruct
oCGridGenMolInfoGridGenMolInfo is an abstract class providing information about the molecule so that the grid generator can fetch atom positions and charges, and shell extents
oCgroup_struct
oChermite_conversion_contrib_struct
oChermite_conversion_info_struct
oChost_name_struct
oCidentify_needed_elements_thread_struct
oCIntegralInfoContains coefficients needed for quick integral evaluation
oCIntegratorCase
oCIntegratorWithMemory
oCinteraction_matrix_limit_range_struct
oCinteraction_matrix_limit_struct
oCJ_std_joblist_thread_struct
oCJFMMWorkerData
oCJK_contribs_buffer_struct
oCjob_list_entry_K_struct
oCjob_list_multipole_entry_J_struct
oCjob_list_standard_entry_J_struct
oCJworker
oCJworkertest
oCK_joblist_thread_struct
oCKworker
oCl_m_struct
oCLinData
oCLinRespBlData
oClistsStruct
oCMatAccInvestigator
oCmatrix_description_struct
oCmatrix_utilities_CompareClass
oCminimal_distr_struct
oCMMInteractor
oCMMLimitTable
oCMMTranslator
oCMoleculeRepresentation of a molecule as a set of nuclei and total charge
oCmonomial_info_struct
oCmonomial_struct
oCmultipole_struct_large
oCmultipole_struct_small
oCMyMolInfo
oCneighbor_basisfunc_struct
oCNeighbourList
oCpair_status_struct
oCpoint_3d_struct
oCpoly_12_struct
oCpoly_12_term_struct
oCpoly_1d_struct_symb
oCpoly_1d_term_struct_symb
oCpoly_3d_struct_symb
oCpoly_3d_term_struct_symb
oCpolydeg1struct
oCpqrs_struct
oCRadialGridA grid describing a radial grid for an atom with a specific charge
oCRadialSchemeRadialScheme describes the radial grid
oCRadialSchemeGC2
oCRadialSchemeLMG
oCRadialSchemeTurbo
oCRandomNumber
oCRGFirstDrv
oCRGFourthDrv
oCRGSecondDrv
oCRGThirdDrv
oCrhoTreeNode_
oCSCF_general
oCSCF_restricted
oCSCF_statistics
oCSCF_timer
oCSCF_unrestricted
oCSecondDrv
oCsetFromFullRule
oCShellSpecStruct_
oCShellSpecStructWithExtent
oCShellTreeClass that allows to find in NLogN time all shells that overlap with a given box
oCSlaterDet_pair_struct
oCSlaterDet_struct
oCSO_struct
oCSparseMatrixSparse matrix structure optimized for XC data access pattern
oCSparseMatrixWrapper
oCSparsePatternA way to store sparse matrix patterns
oCSquareFuncIntegratorProvides temporary storage for compute_integral_of_square_of_basis_func
oCStreamStreamlined, abstract grid generation class
oCStreamSaveContextSaves the grid saving context
oCSum
oCsymb_matrix_element
oCTdebugPolicy
oCThreadInfo
oCtwo_idx_SO_struct
oCuks_data
oCunique_exponent_struct
oCuxc_data
oCvariableDescribes a variable recognized by the scripting system
oCVector3DA representation of Vector or point in cartesian space
oCvwn_params
oCVxc_worker
oCworking_directory_struct
oCxc_data
oCXcData
oCXCDistributorGgaBlas
oCXCDistributorLdaBlas
oCXCEvaluator
oCXCEvaluatorRestricted
oCXCEvaluatorUnrestricted
oCyy_buffer_state
oCyy_trans_info
oCyyalloc
\CYYSTYPE