{ "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" [ [ 0.0662807 0.8720519 0.0908129 ] [ 1.491471 1.392356 0.9155942 ] [ 0.0089195 1.355999 1.632084 ] [ 2.755779 1.093572 2.625507 ] [ 1.848544 2.519779 2.293479 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.62807e-12 8.720519e-11 9.08129e-12 ] [ 1.491471e-10 1.392356e-10 9.155942e-11 ] [ 8.919500000000001e-13 1.355999e-10 1.632084e-10 ] [ 2.755779e-10 1.093572e-10 2.625507e-10 ] [ 1.848544e-10 2.519779e-10 2.293479e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.8414765 -9.8731123 -23.6062536 ] [ 17.0517751 -1.8935198 -15.2561761 ] [ -22.5096236 1.0508633 17.7253295 ] [ 16.0591597 -12.2483895 11.1302677 ] [ 2.2401654 22.9641582 10.0068326 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.057431342485262e-08 -1.581846970159292e-08 -3.782138762259583e-08 ] [ 2.731995540835958e-08 -3.033753154581892e-09 -2.444308867022772e-08 ] [ -3.606439267492793e-08 1.683668610916737e-09 2.839910852087655e-08 ] [ 2.572961022103354e-08 -1.96240832993522e-08 1.783265469218539e-08 ] [ 3.589140630605081e-09 3.679263738439261e-08 1.603271323997928e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 79.151996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.268154774808551e-17 } "relaxed-configuration-positions" { "source-value" [ [ -1.6411982 -0.1418605 -2.0511936 ] [ 3.4775061 1.5792537 -1.0087772 ] [ -1.7580078 1.1109188 3.3062751 ] [ 3.9361145 -0.2863586 4.1447816 ] [ 2.1565795 4.9718045 3.1663912 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.6411982e-10 -1.418605e-11 -2.0511936e-10 ] [ 3.4775061e-10 1.5792537e-10 -1.0087772e-10 ] [ -1.7580078e-10 1.1109188e-10 3.3062751e-10 ] [ 3.9361145e-10 -2.863586e-11 4.1447816e-10 ] [ 2.1565795e-10 4.971804500000001e-10 3.1663912e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }