{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.611679 2.016684 2.717461 ] [ 4.323341 0.727724 2.330974 ] [ 4.46399 3.048062 1.959515 ] [ 3.51112 1.5374 4.631239 ] [ 3.533059 3.74018 3.907793 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.611679e-10 2.016684e-10 2.717461e-10 ] [ 4.323341e-10 7.27724e-11 2.330974e-10 ] [ 4.46399e-10 3.048062e-10 1.959515e-10 ] [ 3.51112e-10 1.5374e-10 4.631239e-10 ] [ 3.533059e-10 3.74018e-10 3.907793e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.1813069 -3.8927363 -4.2228777 ] [ 5.0394548 -8.5465284 -4.8433356 ] [ 7.7403632 6.2532696 -7.8872346 ] [ -0.2575967 -4.2432984 11.1088139 ] [ 0.6590856 10.4292935 5.844634 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.111878174676973e-08 -6.236851090799495e-09 -6.765795923437676e-09 ] [ 8.07409666213834e-09 -1.369304799148323e-08 -7.75987906500834e-09 ] [ 1.240142895554068e-08 1.001884235667937e-08 -1.263674287888484e-08 ] [ -4.127154103352314e-10 -6.798513491558046e-09 1.779828191539807e-08 ] [ 1.055971539425941e-09 1.67095702171614e-08 9.364135951932787e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.6489132 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.244026799568515e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6594101 2.136132 2.7089294 ] [ 4.5049749 0.4039188 2.1286556 ] [ 4.610783 3.1444522 1.3237198 ] [ 3.281091 1.3224834 5.0953053 ] [ 3.3869299 4.0630635 4.2903719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6594101e-10 2.136132e-10 2.708929400000001e-10 ] [ 4.5049749e-10 4.039188e-11 2.1286556e-10 ] [ 4.610783e-10 3.1444522e-10 1.3237198e-10 ] [ 3.281091e-10 1.3224834e-10 5.0953053e-10 ] [ 3.3869299e-10 4.0630635e-10 4.2903719e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.64e-05 -2.96e-05 7.6e-06 ] [ -2.9e-05 -1.05e-05 8.4e-06 ] [ -9e-06 3.73e-05 1.95e-05 ] [ -2.2e-06 4.74e-05 -2.2e-05 ] [ 3.8e-06 -4.46e-05 -1.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.831922899712e-14 -4.742442797568e-14 1.217654231808e-14 ] [ -4.64631220032e-14 -1.68228545184e-14 1.345828361472e-14 ] [ -1.44195895872e-14 5.976118795584e-14 3.12424441056e-14 ] [ -3.52478856576e-15 7.594317182591999e-14 -3.52478856576e-14 ] [ 6.08827115904e-15 -7.145707728768e-14 -2.16293843808e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.196884 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.793938577060959e-18 } }