Removing because examples/meam/msmeam removed

This commit is contained in:
Aidan Thompson
2024-03-01 16:46:55 -05:00
parent 688f4f5288
commit 573021b362
2 changed files with 0 additions and 44 deletions

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bkgd_dyn = 1
emb_lin_neg = 1
augt1=0
ialloy=1
rc = 5.9
#H
attrac(1,1)=0.460
repuls(1,1)=0.460
Cmin(1,1,1)=1.3 # PuMS
Cmax(1,1,1)= 2.80
nn2(1,1)=1
#Ga
rho0(2) = 0.6
attrac(2,2)=0.097
repuls(2,2)=0.097
nn2(2,2)=1
#HGa
attrac(1,2)=0.300
repuls(1,2)=0.300
lattce(1,2)=l12
re(1,2)=3.19
delta(1,2)=-0.48
alpha(1,2)=6.6
Cmin(1,1,2)=2.0
Cmin(2,1,2)= 2.0
Cmin(1,2,1)=2.0
Cmin(2,2,1) = 1.4
Cmin(1,2,2) = 1.4
Cmin(1,1,2) = 1.4
nn2(1,2)=1

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# DATE: 2018-09-22 UNITS: metal CONTRIBUTOR: Steve Valone, smv@lanl.gov CITATION: Baskes, PRB 1992; smv, sr, mib, JNM 2010
# ms-meam data format May 2010
# elt lat z ielement atwt
# alpha b0 b1 b2 b3 b1m b2m b3m alat esub asub
# - t0 t1 t2 t3 t1m t2m t3m rozero ibar
# NOTE: leading character cannot be a space
'H' 'dim' 1.0 1 1.0079
2.960 2.960 3.0 1.0 1.0 1.0 3.0 1.0 0.741 2.235 2.50
1.0 0.44721 0.0 0.00 0.0 0.31623 0 6.70 0
'Ga4' 'fcc' 12.0 31 69.723
4.42 4.80 3.10 6.00 0.00 0.0 0.0 0.5 4.247 2.897 0.97
1.0 1.649 1.435 0.00 0.0 0.0 2.0 0.70 0