{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.344878 2.219137 2.797465 ] [ 2.001288 4.461966 3.139291 ] [ 3.23388 2.535754 1.187329 ] [ 4.3257 4.424828 2.075195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.344878e-10 2.219137e-10 2.797465e-10 ] [ 2.001288e-10 4.461966000000001e-10 3.139291e-10 ] [ 3.23388e-10 2.535754e-10 1.187329e-10 ] [ 4.3257e-10 4.424828e-10 2.075195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1956194 0.5958493 -0.8970085 ] [ 1.4579976 -0.5449632 -0.8294257 ] [ -0.9719687 0.2175244 1.2124363 ] [ -1.6816484 -0.2684105 0.5139978 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.915593450054924e-09 9.546558179800455e-10 -1.437166047358877e-09 ] [ 2.33596966790251e-09 -8.731272982363546e-10 -1.328886465230675e-09 ] [ -1.557265527289369e-09 3.485125081335475e-10 1.942537094069255e-09 ] [ -2.694297750885727e-09 -4.300410278772384e-10 8.235152583026342e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7989828 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.569970114978132e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2740183 2.2847007 2.6235732 ] [ 2.2047239 4.3416967 3.197452 ] [ 3.2482585 2.4790552 1.4023419 ] [ 4.1787453 4.5362324 1.9759129 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2740183e-10 2.2847007e-10 2.6235732e-10 ] [ 2.2047239e-10 4.3416967e-10 3.197452e-10 ] [ 3.2482585e-10 2.4790552e-10 1.4023419e-10 ] [ 4.1787453e-10 4.5362324e-10 1.9759129e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.00011 6.5e-06 -4e-07 ] [ -5.35e-05 -1.75e-05 -4.43e-05 ] [ -0.0001162 1.49e-05 1.71e-05 ] [ 5.96e-05 -3.9e-06 2.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.76239428288e-13 1.04141480352e-14 -6.408706483200001e-16 ] [ -8.57164492128e-14 -2.8038090864e-14 -7.097642430144e-14 ] [ -1.8617292333696e-13 2.387243164992e-14 2.739722021568e-14 ] [ 9.548972659968001e-14 -6.24848882112e-15 4.422007473408001e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.314569 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.652576130542844e-18 } }