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Atomic-orbital Based Ab-initio Computation at UStc
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test_deepks< T > Member List
This is the complete list of members for
test_deepks< T >
, including all inherited members.
alpha_
test_deepks< T >
cal_V_delta
()
test_deepks< T >
check_descriptor
(std::vector< torch::Tensor > &descriptor)
test_deepks< T >
check_dstable
()
test_deepks< T >
check_e_deltabands
()
test_deepks< T >
check_edelta
(std::vector< torch::Tensor > &descriptor)
test_deepks< T >
check_f_delta_and_stress_delta
()
test_deepks< T >
check_gdmepsl
(torch::Tensor &gdmepsl)
test_deepks< T >
check_gdmx
(torch::Tensor &gdmx)
test_deepks< T >
check_gvepsl
(torch::Tensor &gdmepsl)
test_deepks< T >
check_gvx
(torch::Tensor &gdmx)
test_deepks< T >
check_o_delta
()
test_deepks< T >
check_orbpre
()
test_deepks< T >
check_pdm
()
test_deepks< T >
check_phialpha
()
test_deepks< T >
check_vdpre
()
test_deepks< T >
check_vdrpre
()
test_deepks< T >
compare_with_ref
(const std::string f1, const std::string f2)
test_deepks< T >
count_ntype
()
test_deepks< T >
dm
test_deepks< T >
dm_new
test_deepks< T >
failed_check
test_deepks< T >
kv
test_deepks< T >
lcao_dk
test_deepks< T >
lcao_dr
test_deepks< T >
lcao_ecut
test_deepks< T >
lcao_rmax
test_deepks< T >
ld
test_deepks< T >
lmax
test_deepks< T >
my_rank
test_deepks< T >
ntype
test_deepks< T >
ORB
test_deepks< T >
orb_
test_deepks< T >
out_mat_r
test_deepks< T >
overlap_orb_alpha_
test_deepks< T >
p_elec_DM
test_deepks< T >
ParaO
test_deepks< T >
prep_neighbour
()
test_deepks< T >
preparation
()
test_deepks< T >
read_dm
(const int nks)
test_deepks< T >
set_dm_new
()
test_deepks< T >
set_ekcut
()
test_deepks< T >
set_orbs
()
test_deepks< T >
set_p_elec_DM
()
test_deepks< T >
set_parameters
()
test_deepks< T >
setup_cell
()
test_deepks< T >
setup_kpt
()
test_deepks< T >
test_deepks
()
test_deepks< T >
TH
typedef
test_deepks< T >
total_check
test_deepks< T >
ucell
test_deepks< T >
~test_deepks
()
test_deepks< T >
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