MPI-SCATCI
2.0
An MPI version of SCATCI
options_module::options Member List
This is the complete list of members for
options_module::options
, including all inherited members.
actual_num_csfs
options_module::options
all_ecp_defined
options_module::options
arrange_phase
options_module::options
private
check_sanity_complete
options_module::options
private
check_sanity_congen_header
options_module::options
private
ci_output_unit
options_module::options
ci_phase
options_module::options
ci_sequence_number
options_module::options
ci_set_number
options_module::options
ci_target_flag
options_module::options
ci_target_switch
options_module::options
compute_expansions
options_module::options
private
compute_variables
options_module::options
private
continuum_block_size
options_module::options
contracted_mat_size
options_module::options
csf_type
options_module::options
diag_name
options_module::options
diagonalization_flag
options_module::options
diagonalizer_choice
options_module::options
do_ci_contraction
options_module::options
ecp_filename
options_module::options
ecp_type
options_module::options
eigenvec_conv
options_module::options
energy_shifts
options_module::options
exclude_rowcolumn
options_module::options
exotic_mass
options_module::options
following_writer
options_module::options
force_serial
options_module::options
gerade_sym_continuum_orbital_target
options_module::options
hamiltonian_unit
options_module::options
integral_ordering
options_module::options
integral_unit
options_module::options
lambda
options_module::options
lambda_continuum_orbitals_target
options_module::options
last_continuum
options_module::options
length_coeff
options_module::options
length_dtrs
options_module::options
matrix_eval
options_module::options
max_iterations
options_module::options
max_tolerance
options_module::options
maximum_num_target_states
options_module::options
megul
options_module::options
multiplicity_defined
options_module::options
name
options_module::options
num_ci_target_sym
options_module::options
num_continuum
options_module::options
num_continuum_orbitals_target
options_module::options
num_csfs
options_module::options
num_dtr_csf_out
options_module::options
num_eigenpairs
options_module::options
num_electronic_orbitals_sym
options_module::options
num_electrons
options_module::options
num_expanded_continuum_csf
options_module::options
num_l2_csf
options_module::options
num_matrix_elements_per_rec
options_module::options
num_orbitals_sym
options_module::options
num_orbitals_sym_dinf
options_module::options
num_positron_orbitals_sym
options_module::options
num_syms
options_module::options
num_target_orbitals_sym
options_module::options
num_target_orbitals_sym_congen
options_module::options
num_target_orbitals_sym_dinf_congen
options_module::options
num_target_state_sym
options_module::options
num_target_sym
options_module::options
num_unused_orbitals_sym
options_module::options
orbital_sequence_number
options_module::options
orthog_trigger
options_module::options
output_ci_set_number
options_module::options
output_flag
options_module::options
phase_correction_flag
options_module::options
phase_index
options_module::options
pin
options_module::options
positron_flag
options_module::options
preceding_writer
options_module::options
print_dataset_heading
options_module::options
print_flags
options_module::options
quantamoln
options_module::options
read
=> read_input
options_module::options
read_congen
options_module::options
private
reference_dtrs
options_module::options
refl_quanta
options_module::options
residual_conv
options_module::options
seq_num_last_continuum_csf
options_module::options
spatial_defined
options_module::options
spin
options_module::options
spin_z
options_module::options
sym_group_flag
options_module::options
target_multiplicity
options_module::options
target_spatial
options_module::options
temp_orbs
options_module::options
threshold
options_module::options
tot_num_orbitals
options_module::options
tot_num_spin_orbitals
options_module::options
total_memory
options_module::options
total_num_ci_target
options_module::options
total_num_target_states
options_module::options
total_num_tgt_states
options_module::options
use_scf
options_module::options
use_ukrmol_integrals
options_module::options
vector_storage_method
options_module::options
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