{ "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" [ [ 0.9312002 0.7437347 1.637203 ] [ 0.2868751 2.587784 1.486301 ] [ 2.468756 0.0419283 1.950884 ] [ 2.101698 2.93019 0.1307908 ] [ 2.374683 2.856414 2.678274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.312002000000001e-11 7.437347e-11 1.637203e-10 ] [ 2.868751e-11 2.587784e-10 1.486301e-10 ] [ 2.468756e-10 4.19283e-12 1.950884e-10 ] [ 2.101698e-10 2.93019e-10 1.307908e-11 ] [ 2.374683e-10 2.856414e-10 2.678274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7550065 -2.3530258 -0.9240324 ] [ -2.3151658 5.1305727 0.0421682 ] [ 6.4702385 -2.0217274 1.4377202 ] [ 0.6636714 -0.0424332 0.2498318 ] [ -0.0637376 -0.7133862 -0.8056879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.618360246052036e-09 -3.769962924899217e-09 -1.480463108141714e-09 ] [ -3.709304518035729e-09 8.220083631254734e-09 6.756090418121856e-11 ] [ 1.036646485570006e-08 -3.23916437391077e-09 2.3034816916919e-09 ] [ 1.063318800973605e-09 -6.798548098573056e-11 4.002746690923815e-10 ] [ -1.021188925859021e-10 -1.142970691241353e-09 -1.290854317041448e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.91522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.909028691568858e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5284462 0.5973353 1.095683 ] [ 0.2668866 2.8602571 1.8057203 ] [ 2.7451957 0.5766266 1.9782784 ] [ 2.1390475 2.2862829 0.3154542 ] [ 2.4836362 2.8395491 2.688317 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.284462e-11 5.973353e-11 1.095683e-10 ] [ 2.668866e-11 2.8602571e-10 1.8057203e-10 ] [ 2.7451957e-10 5.766266e-11 1.9782784e-10 ] [ 2.1390475e-10 2.2862829e-10 3.154542e-11 ] [ 2.4836362e-10 2.8395491e-10 2.688317e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.39e-05 1.47e-05 4e-07 ] [ 1.05e-05 -5.6e-06 -1.1e-06 ] [ -6.7e-06 1.16e-05 -1.2e-06 ] [ -1.04e-05 -9.8e-06 9.6e-06 ] [ -7.2e-06 -1.09e-05 -7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.227025502912e-14 2.355199632576e-14 6.408706483200001e-16 ] [ 1.68228545184e-14 -8.972189076479999e-15 -1.76239428288e-15 ] [ -1.073458335936e-14 1.858524880128e-14 -1.92261194496e-15 ] [ -1.666263685632e-14 -1.570133088384e-14 1.538089555968e-14 ] [ -1.153567166976e-14 -1.746372516672e-14 -1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }