mirror of https://github.com/abinit/abinit.git
35 lines
715 B
Plaintext
35 lines
715 B
Plaintext
surf 1
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crit 2
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atom 1
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gpsurf 1
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irho 1
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ivol 1
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inpt 10
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ntheta 4
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nphi 4
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atrad 1.0
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radstp 0.03
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ratmin 0.80
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maxatd 10.0
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maxcpd 10.0
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#%%<BEGIN TEST_INFO>
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#%% [setup]
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#%% executable = aim
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#%% test_chain = t18.abi, t19.abi
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#%% [files]
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#%% files_to_test =
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#%% t19.out, tolnlines = 0, tolabs = 0.0, tolrel = 0.0, fld_options = -easy
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#%% psp_files = DensityCore_pw/01-H.8.fc, DensityCore_pw/53-I.8.fc
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#%% [paral_info]
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#%% max_nprocs = 1
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#%% [extra_info]
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#%% authors = Unknown
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#%% keywords =
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#%% description =
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#%% HI 8 molecule per cell, the cell is triclinic.
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#%% Bader analysis for the first atom.
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#%% Previously, there was a bug, not active when the cell has symmetric axes.
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#%% topics = Bader
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#%%<END TEST_INFO>
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