{ "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" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 20.4646495 18.7460043 -69.4721422 ] [ -25.4917801 -28.543089 64.6252845 ] [ -4.2921703 0.8847763 -85.1298952 ] [ 91.7833477 -19.7623234 51.691116 ] [ -82.4640467 28.6746318 38.285637 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.278798325189978e-08 3.003441007032352e-08 -1.113066429467653e-07 ] [ -4.084233443528618e-08 -4.573107025798242e-08 1.035411207915024e-07 ] [ -6.87681496380877e-09 1.417567914176974e-09 -1.363931289443088e-07 ] [ 1.470531350752376e-07 -3.166273278503143e-08 8.281829824058353e-08 ] [ -1.321219687678248e-07 4.594182505851336e-08 6.134035301920585e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 60.959956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.76686171128681e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8300626 0.6134948 0.5061593 ] [ 0.1207569 0.8745751 2.7029453 ] [ 2.7010038 1.9543299 0.1916974 ] [ 3.1480031 3.0440918 2.1941352 ] [ 1.5533225 2.376767 3.7461718 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.300626e-11 6.134948e-11 5.061593e-11 ] [ 1.207569e-11 8.745751000000001e-11 2.7029453e-10 ] [ 2.7010038e-10 1.9543299e-10 1.916974e-11 ] [ 3.1480031e-10 3.0440918e-10 2.1941352e-10 ] [ 1.5533225e-10 2.376767e-10 3.7461718e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 -3e-07 3e-07 ] [ -6e-07 -1e-07 2e-07 ] [ 6e-07 4e-07 -0.0 ] [ 3e-07 3e-07 -3e-07 ] [ 0.0 -4e-07 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.204353268e-16 -4.806529901999999e-16 4.806529901999999e-16 ] [ -9.613059803999998e-16 -1.602176634e-16 3.204353268e-16 ] [ 9.613059803999998e-16 6.408706536e-16 0.0 ] [ 4.806529901999999e-16 4.806529901999999e-16 -4.806529901999999e-16 ] [ 0.0 -6.408706536e-16 -1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.435516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992389316693314e-18 } }