mirror of https://github.com/abinit/abinit.git
33 lines
905 B
Plaintext
33 lines
905 B
Plaintext
# anaddb input file to compute DFPT properties of AlP,
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# based on previous abinit computations in tpolarization_2.abi
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# General information
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#********************
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rfmeth 1
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chneut 2
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# Flags
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#*******
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elaflag 3
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piezoflag 3
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instrflag 1
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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 = anaddb
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#%% test_chain = tpolarization_2.abi, tpolarization_3.abi
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#%% input_ddb = tpolarization_2o_DS3_DDB
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#%% [files]
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#%% files_to_test =
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#%% tpolarization_3.abo, tolnlines= 2, tolabs= 5.000e-07, tolrel= 3.000e-04, fld_options=-medium
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#%% [paral_info]
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#%% max_nprocs = 4
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#%% [extra_info]
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#%% authors = J. Zwanziger, M. Veithen, P. Ghosez
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#%% keywords =
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#%% description = Anaddb input file.
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#%%<END TEST_INFO>
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