mirror of https://github.com/abinit/abinit.git
46 lines
1.6 KiB
Plaintext
46 lines
1.6 KiB
Plaintext
&FILES
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ddkfile_1 = 'toptic_3o_DS4_1WF7',
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ddkfile_2 = 'toptic_3o_DS5_1WF8',
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ddkfile_3 = 'toptic_3o_DS6_1WF9',
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wfkfile = 'toptic_3o_DS3_WFK'
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/
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&PARAMETERS
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broadening = 0.002,
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domega = 0.0003,
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maxomega = 0.3,
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scissor = 0.000,
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tolerance = 0.002
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/
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&COMPUTATIONS
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num_lin_comp = 0,
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lin_comp = 0,
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num_nonlin_comp = 0
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nonlin_comp = 0,
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num_linel_comp = 1,
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linel_comp = 123,
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/
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##############################################################
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# This section is used only for regression testing of ABINIT #
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##############################################################
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#%%<BEGIN TEST_INFO>
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#%% [setup]
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#%% executable = optic
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#%% test_chain = toptic_3.abi,toptic_4.abi,toptic_5.abi
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#%% need_cpp_vars = !HAVE_MPI_IO_DEFAULT
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#%% [files]
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#%% files_to_test =
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#%% toptic_5_0001_0002_0003-ChiEOAbs.out, tolnlines= 16, tolabs= 7.000e-04, tolrel= 7.000e-04, fld_options = -easy;
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#%% toptic_5_0001_0002_0003-ChiEOIm.out, tolnlines= 16, tolabs= 7.000e-04, tolrel= 7.000e-04, fld_options = -easy;
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#%% toptic_5_0001_0002_0003-ChiEORe.out, tolnlines= 16, tolabs= 7.000e-04, tolrel= 7.000e-04, fld_options = -easy;
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#%% toptic_5_0001_0002_0003-ChiEOTotIm.out, tolnlines= 16, tolabs= 7.000e-04, tolrel= 7.000e-04, fld_options = -easy;
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#%% toptic_5_0001_0002_0003-ChiEOTotRe.out, tolnlines= 16, tolabs= 7.000e-04, tolrel= 7.000e-04, fld_options = -easy;
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#%% [paral_info]
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#%% max_nprocs = 4
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#%% [extra_info]
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#%% authors = S. Sharma, X. Gonze, N. A. Pike
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#%% keywords = linear electro-optical coefficient
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#%% description = Input file for optic code to calculate the linear electro-optical coefficient
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#%%<END TEST_INFO>
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