restore showing references to potential files without pathnames

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Axel Kohlmeyer 2019-08-01 11:19:39 -04:00
parent 02511a0ae5
commit 5fe457667e
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2 changed files with 7 additions and 7 deletions

View File

@ -18,12 +18,12 @@ tap_flag = 0/1 to turn off/on the taper function :ul
[Examples:]
pair_style hybrid/overlay ilp/graphene/hbn 16.0 1
pair_coeff * * ilp/graphene/hbn ../potentials/BNCH.ILP B N C :pre
pair_coeff * * ilp/graphene/hbn BNCH.ILP B N C :pre
pair_style hybrid/overlay rebo tersoff ilp/graphene/hbn 16.0 coul/shield 16.0
pair_coeff * * rebo ../potentials/CH.rebo NULL NULL C
pair_coeff * * tersoff ../potentials/BNC.tersoff B N NULL
pair_coeff * * ilp/graphene/hbn ../potentials/BNCH.ILP B N C
pair_coeff * * rebo CH.rebo NULL NULL C
pair_coeff * * tersoff BNC.tersoff B N NULL
pair_coeff * * ilp/graphene/hbn BNCH.ILP B N C
pair_coeff 1 1 coul/shield 0.70
pair_coeff 1 2 coul/shield 0.695
pair_coeff 2 2 coul/shield 0.69 :pre

View File

@ -19,11 +19,11 @@ tap_flag = 0/1 to turn off/on the taper function :ul
pair_style hybrid/overlay kolmogorov/crespi/full 20.0 0
pair_coeff * * none
pair_coeff * * kolmogorov/crespi/full ../potentials/CH.KC C C :pre
pair_coeff * * kolmogorov/crespi/full CH.KC C C :pre
pair_style hybrid/overlay rebo kolmogorov/crespi/full 16.0 1
pair_coeff * * rebo ../potentials/CH.rebo C H
pair_coeff * * kolmogorov/crespi/full ../potentials/CH_taper.KC C H :pre
pair_coeff * * rebo CH.rebo C H
pair_coeff * * kolmogorov/crespi/full CH_taper.KC C H :pre
[Description:]