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MPI-SCATCI 2.0
An MPI version of SCATCI
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Go to the source code of this file.
Data Types | |
| type | BaseCorePotential_module::BaseCorePotential |
| interface | BaseCorePotential_module::generic_ecp |
| Main build routine of the hamiltonian. More... | |
| interface | BaseCorePotential_module::generic_input |
| Main build routine of the hamiltonian. More... | |
| interface | BaseCorePotential_module::generic_energy |
Modules | |
| module | BaseCorePotential_module |
| Base type for core potentials. | |
Functions/Subroutines | |
| subroutine | BaseCorePotential_module::construct_core (this, num_target_sym, num_target_per_symmetries, spatial_symmetry, spin_symmetry) |
| subroutine | BaseCorePotential_module::modify_ecp_diagonal (this, value) |
| subroutine | BaseCorePotential_module::modify_ecp_diagonal_L2 (this, value) |