15 lines
386 B
Plaintext
15 lines
386 B
Plaintext
boundary p p f
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kspace_style ewald/electrode 1.0e-8
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kspace_modify slab 8.0 # ew3dc
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include "settings.mod" # styles, computes, groups and fixes
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thermo_style custom step pe c_qbot c_qtop
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fix feta all property/atom d_eta ghost on
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set group bot d_eta 0.5
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set group top d_eta 3.0
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fix conp bot electrode/conp 0 NULL couple top 1 symm on eta d_eta write_inv inv.csv write_vec vec.csv
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run 0
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