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defined in DASSEMBLERS/getforce_classic_RGL.f90
Used form of the interaction and parameters from Riccardo Ferrando:
# [alpha, p, q, A, dzeta, ro in bulk, Z (# neigh), cutoff ]# cutoff=ro+0.18*sqrt(2)*ro #pure metal Co #Co-Co=[ 0.5, 9.21000000, 2.97500000, 0.17821769, 1.86943884, 2.50000000, 8, 3.13639609]
Download the exapmle of RGL.dat file here.
The Pd-Pd clusters are tested with the code of prof. R. Ferrando. The RGL potential is available for: Co,Ni,Cu,Rh,Pd,Ag,Ir,Au,Pt
, and for their bi-metalic alloys: i.e Co-{Ni,Cu,Rh,Pd,Ag,Ir,Pt,Au}, Ni-{Co,Cu,Rh,Pd,Ag,Ir,Pt,Au},Cu-{Co,Ni,Rh,Pd,Ag,Ir,Pt,Au},…