{ "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" [ [ 2.61188 5.080623 2.93239 ] [ 4.855786 1.762639 3.084137 ] [ 3.780411 3.32193 1.747479 ] [ 4.346291 4.090656 3.759617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61188e-10 5.080623e-10 2.93239e-10 ] [ 4.855786000000001e-10 1.762639e-10 3.084137e-10 ] [ 3.780411e-10 3.32193e-10 1.747479e-10 ] [ 4.346291e-10 4.090656e-10 3.759617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1810828 4.0403793 -0.4339292 ] [ 1.4886474 -3.6690013 0.9484355 ] [ -1.3182402 -2.2896802 -8.3003934 ] [ 5.0106756 1.9183022 7.7858871 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.301009732589003e-09 6.47340125362427e-09 -6.952312193224473e-10 ] [ 2.385076060894706e-09 -5.878388104544808e-09 1.519561184436758e-09 ] [ -2.112053629038716e-09 -3.668472085548668e-09 -1.329869624892262e-08 ] [ 8.027987300733013e-09 3.073458936469206e-09 1.247436628380831e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7113446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.548406170652329e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.9314184 4.9437863 2.7694721 ] [ 4.8657495 2.1841273 2.9923481 ] [ 3.382847 3.078648 1.3478486 ] [ 4.4143531 4.0492864 4.4139542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9314184e-10 4.9437863e-10 2.7694721e-10 ] [ 4.8657495e-10 2.1841273e-10 2.9923481e-10 ] [ 3.382847e-10 3.078648e-10 1.3478486e-10 ] [ 4.4143531e-10 4.0492864e-10 4.4139542e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.27e-05 4.7e-06 5e-07 ] [ 6.5e-06 4.5e-06 -1.11e-05 ] [ 1.29e-05 8.1e-06 6.2e-05 ] [ -3.21e-05 -1.73e-05 -5.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.034764308416e-14 7.53023011776e-15 8.010883104e-16 ] [ 1.04141480352e-14 7.2097947936e-15 -1.778416049088e-14 ] [ 2.066807840832e-14 1.297763062848e-14 9.93349504896e-14 ] [ -5.142986952768e-14 -2.771765553984e-14 -8.235187830912e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.6918948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.392595063901309e-18 } }