{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7640613 0.2474373 1.904604 ] [ 0.7957024 2.286987 0.9838997 ] [ 2.800961 0.7755534 0.6501687 ] [ 2.57314 0.3921087 2.718963 ] [ 2.488072 2.896141 0.3463324 ] [ 2.197679 2.730757 1.909926 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.640613000000001e-11 2.474373e-11 1.904604e-10 ] [ 7.957024000000001e-11 2.286987e-10 9.838997e-11 ] [ 2.800961e-10 7.755534e-11 6.501687e-11 ] [ 2.57314e-10 3.921087e-11 2.718963e-10 ] [ 2.488072e-10 2.896141e-10 3.463324e-11 ] [ 2.197679e-10 2.730757e-10 1.909926e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3920901 -0.2275998 -2.2571533 ] [ -29.7798741 -8.1541576 -9.2675728 ] [ -0.9132504 -6.7921256 0.6705558 ] [ 6.4098191 -0.8808313 3.4510801 ] [ 15.3751777 12.5595346 -27.6810077 ] [ 12.3002178 3.4951797 35.0840979 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.434727498642723e-09 -3.646550814630732e-10 -3.616358276615992e-09 ] [ -4.771261844648178e-08 -1.306440077667352e-08 -1.484828859405395e-08 ] [ -1.463188451871154e-09 -1.088218493151323e-08 1.074348834553177e-09 ] [ 1.026966239018691e-08 -1.411247327355844e-09 5.529239898282382e-09 ] [ 2.463375045453786e-08 2.012259287003453e-08 -4.434986374251407e-08 ] [ 1.970712155227088e-08 5.59989524697113e-09 5.621092188034846e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.43721064435738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.507018580525478e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3364633 0.4728528 1.9711685 ] [ 0.6571361 2.2307494 0.4370394 ] [ 2.3519051 0.674068 0.7026709 ] [ 3.5093261 0.7239871 2.6259952 ] [ 2.8892664 2.9788596 0.3698832 ] [ 1.8755187 2.2484675 2.4071367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.364633e-11 4.728528e-11 1.9711685e-10 ] [ 6.571361e-11 2.2307494e-10 4.370394e-11 ] [ 2.3519051e-10 6.74068e-11 7.026709000000001e-11 ] [ 3.5093261e-10 7.239871000000001e-11 2.6259952e-10 ] [ 2.8892664e-10 2.9788596e-10 3.698832000000001e-11 ] [ 1.8755187e-10 2.2484675e-10 2.4071367e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.51e-05 5.09e-05 -6.07e-05 ] [ 4.36e-05 -2.68e-05 2.18e-05 ] [ -3.41e-05 5.32e-05 6.81e-05 ] [ 4.8e-05 -3.27e-05 -1.69e-05 ] [ -5.61e-05 -4.93e-05 9.9e-06 ] [ -3.65e-05 4.7e-06 -2.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.62363998534e-14 8.155079067059998e-14 -9.725212168379999e-14 ] [ 6.985490124239999e-14 -4.293833379119999e-14 3.492745062119999e-14 ] [ -5.46342232194e-14 8.523579692879999e-14 1.091082287754e-13 ] [ 7.690447843199999e-14 -5.23911759318e-14 -2.70767851146e-14 ] [ -8.988210916739999e-14 -7.89873080562e-14 1.58615486766e-14 ] [ -5.847944714099999e-14 7.530230179799999e-15 -3.572853893819999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.80036905564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.691715874352725e-18 } }