mirror of https://github.com/abinit/abinit.git
37 lines
959 B
Plaintext
37 lines
959 B
Plaintext
##############################################################################
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#Test for multibinit restart molecular dynamics
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##############################################################################
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prt_model = 0
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dipdip_prt = 0
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ncell = 2 2 2
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ngqpt = 2 2 2
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dipdip = 1
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dynamics = 13
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restartxf = -3
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dtion = 40
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optcell = 2
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temperature = 50
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ntime = 50
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strtarget = 3*0 3*0
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#%%<BEGIN TEST_INFO>
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#%% [setup]
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#%% executable = multibinit
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#%% system_xml = t38_model.xml
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#%% [shell]
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#%% pre_commands =
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#%% iw_cp t38.abo_HIST.nc t38.abo_HIST.nc;
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#%% [files]
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#%% files_to_test =
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#%% t38.abo, tolnlines = 0, tolabs = 0.0, tolrel = 0.0, fld_options = -easy;
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#%% [paral_info]
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#%% max_nprocs = 1
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#%% [extra_info]
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#%% authors = M. M. Schmitt
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#%% keywords = Effective potential, multibinit
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#%% description =
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#%% Restart a Molecular-Dynamics run from a _HIST.nc file with one step in it.
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#%% topics = LatticeModel,DynamicsMultibinit
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#%%<END TEST_INFO>
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