quantum-espresso/HP/CMakeLists.txt

85 lines
1.9 KiB
CMake

set(src_hp
src/hp_allocate_q.f90
src/hp_bcast_input.f90
src/hpcom.f90
src/hp_clean_q.f90
src/hp_close_q.f90
src/hp_calc_chi.f90
src/hp_check_pert.f90
src/hp_check_type.f90
src/hp_dnstot_sum_q.f90
src/hp_dnsq.f90
src/hp_dealloc_q.f90
src/hp_dealloc_1.f90
src/hp_dealloc_2.f90
src/hp_dvpsi_pert.f90
src/hp_find_inequiv_sites.f90
src/hp_generate_grids.f90
src/hp_init.f90
src/hp_init_q.f90
src/hp_load_q.f90
src/hp_ns_trace.f90
src/hp_openfil_q.f90
src/hp_psym_dmag.f90
src/hp_psymdvscf.f90
src/hp_postproc.f90
src/hp_prepare_q.f90
src/hp_print_clock.f90
src/hp_q_points.f90
src/hp_R_points.f90
src/hp_rotate_dnsq.f90
src/hp_readin.f90
src/hp_read_chi.f90
src/hp_read_dnsq.f90
src/hp_run_nscf.f90
src/hp_solve_linear_system.f90
src/hp_symdnsq.f90
src/hp_sym_dmag.f90
src/hp_symdvscf.f90
src/hp_setup_q.f90
src/hp_summary.f90
src/hp_summary_q.f90
src/hp_stop_smoothly.f90
src/hp_write_chi.f90
src/hp_write_chi_full.f90
src/hp_write_dnsq.f90)
qe_add_library(qe_hp ${src_hp})
target_link_libraries(qe_hp
PRIVATE
qe_pw
qe_lr_modules
qe_modules
qe_fftx
qe_upflib
qe_xclib)
###########################################################
# hp.x
###########################################################
set(src_hp_x src/hp_main.f90)
qe_enable_cuda_fortran("${src_hp_x}")
qe_add_executable(qe_hp_exe ${src_hp_x})
set_target_properties(qe_hp_exe
PROPERTIES
OUTPUT_NAME hp.x)
target_link_libraries(qe_hp_exe
PRIVATE
qe_pw
qe_lax
qe_modules
qe_hp
qe_xclib)
###########################################################
qe_install_targets(
qe_hp
qe_hp_exe)
add_custom_target(hp
DEPENDS
qe_hp_exe
COMMENT
"calculation of the Hubbard parameters from DFPT")