{ "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" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5824875 -18.5989569 -30.1027874 ] [ -6.3447115 17.8381216 33.418044 ] [ 2.1633451 -0.6105068 0.1392943 ] [ 5.1371398 1.9996139 -6.3964853 ] [ 0.6267141 -0.6282718 2.9419344 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.53542447520824e-09 -2.979881391644684e-08 -4.822998219319282e-08 ] [ -1.01653484310209e-08 2.857982138650749e-08 5.354160880966572e-08 ] [ 3.466060941942238e-09 -9.781397217994215e-10 2.231740708707015e-10 ] [ 8.230605285341188e-09 3.203734641206709e-09 -1.024829920295088e-08 ] [ 1.004106678945713e-09 -1.006602389467934e-09 4.713498515607275e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.4293446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.494415742786728e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2600467 0.8226301 0.0241753 ] [ -0.2198053 2.0862661 2.0363778 ] [ 3.3140401 0.407316 1.8902336 ] [ 1.8211092 1.8105574 0.6599804 ] [ 1.8862468 1.841488 3.1359981 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.600467e-11 8.226301e-11 2.41753e-12 ] [ -2.198053e-11 2.0862661e-10 2.0363778e-10 ] [ 3.3140401e-10 4.07316e-11 1.8902336e-10 ] [ 1.8211092e-10 1.8105574e-10 6.599804000000001e-11 ] [ 1.8862468e-10 1.841488e-10 3.1359981e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.21e-05 -4.3e-06 -2.21e-05 ] [ -3.7e-06 -1.95e-05 7.5e-06 ] [ -3.24e-05 5.1e-06 6.2e-06 ] [ 1.7e-05 5.3e-06 3.6e-06 ] [ 3.12e-05 1.34e-05 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.938633711168e-14 -6.889359469440001e-15 -3.540810331968e-14 ] [ -5.928053496960001e-15 -3.12424441056e-14 1.2016324656e-14 ] [ -5.191052251392001e-14 8.17110076608e-15 9.93349504896e-15 ] [ 2.72370025536e-14 8.491536090240001e-15 5.76783583488e-15 ] [ 4.998791056896e-14 2.146916671872e-14 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.607069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.180092782941243e-18 } }