mirror of https://github.com/abinit/abinit.git
50 lines
1.6 KiB
Plaintext
50 lines
1.6 KiB
Plaintext
##############################################################################
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#Test for multibinit, just read xml and generate the effective potential into XML file
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# without regeneration of dipole-dipole just reading xml
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##############################################################################
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prt_model = 0
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dynamics = 0
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ncell = 6 6 6
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temperature = 600
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#-------------------------------------------------------------
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#Spin dynamics
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#------------------------------------------------------------
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spin_init_state = 3
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spin_init_orientation = 1 1 0
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spin_init_qpoint = 0.5 0 0.0
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spin_init_rotate_axis = 0 1 0
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spin_mag_field= 0.0 0.0 0.0
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spin_dynamics=1
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spin_temperature = 0
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spin_ntime =1
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spin_nctime=1
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spin_dt=1e-16 s
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randomseed=111111 # for testing purpose only
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#%%<BEGIN TEST_INFO>
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#%% [setup]
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#%% executable = multibinit
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#%% need_cpp_vars = HAVE_XML
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#%% exclude_builders = .*_nag_7.[01]_.*
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#%% spin_pot = t81.xml
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#%% exec_args = --F03
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#%% [files]
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#%% files_to_test =
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#%% t81.abo, tolnlines = 0, tolabs = 1e-6, tolrel = 0.000001, fld_options = -medium;
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#%% [paral_info]
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#%% max_nprocs = 1
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#%% [extra_info]
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#%% authors = X. He
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#%% keywords = Effective potential, multibinit, spinpot
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#%% description =
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#%% This is to test the spin_init_state 3 option for spin dynamics in Multibinit.
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#%% The initial spin state is set using three variables spin_init_*.
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#%% Disabled on nag@abiref because integer overflow (-C=intovf option of NAG compiler)
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#%% is detected, which is needed by the random number generator.
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#%% The random number generator in in 28_numeric_noabirule/m_random_xoroshiro128plus.F90
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#%%<END TEST_INFO>
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