{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.0786363 -7.6094458 -1.3861399 ] [ 2.5557841 -25.3545472 -1.2608799 ] [ -0.5570096 -1.4326305 2.5530635 ] [ 0.2338858 0.7181879 -0.8801551 ] [ 13.8697483 10.1715807 2.8773695 ] [ -8.888961 8.6161204 -22.7096729 ] [ 2.8651887 14.8907344 20.8064149 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.614775544940621e-08 -1.219167615800475e-08 -2.22084094093805e-09 ] [ 4.094817532832369e-09 -4.06224627548101e-08 -2.020152297416642e-09 ] [ -8.924277586811597e-10 -2.295327093345014e-09 4.090458651117821e-09 ] [ 3.747263606971047e-10 1.150663862721448e-09 -1.410163923897886e-09 ] [ 2.222178646264054e-08 1.62966687941205e-08 4.610054142302985e-09 ] [ -1.424168549740299e-08 1.380454666687794e-08 -3.638490698639534e-08 ] [ 4.590538349320345e-09 2.385758652222232e-08 3.333555151544477e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5193645 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.525170324677348e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9305432 2.7822035 2.8026788 ] [ 4.9307029 1.2526776 1.6608537 ] [ 5.154159 2.3317788 4.2340712 ] [ 3.2756868 0.8523868 3.4950003 ] [ 5.7507524 3.6390907 2.1114358 ] [ 3.5032775 3.30053 0.926129 ] [ 3.7268141 4.379635 3.4991992 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9305432e-10 2.7822035e-10 2.8026788e-10 ] [ 4.9307029e-10 1.2526776e-10 1.6608537e-10 ] [ 5.154159e-10 2.3317788e-10 4.2340712e-10 ] [ 3.2756868e-10 8.523868000000001e-11 3.4950003e-10 ] [ 5.7507524e-10 3.6390907e-10 2.1114358e-10 ] [ 3.5032775e-10 3.30053e-10 9.26129e-11 ] [ 3.7268141e-10 4.379635e-10 3.4991992e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.4e-06 -1.83e-05 -3.03e-05 ] [ -7.3e-06 -2.04e-05 -1.42e-05 ] [ 7.7e-06 -1.72e-05 1.02e-05 ] [ -4.5e-06 3.71e-05 2.47e-05 ] [ 9.7e-06 2.04e-05 -1.31e-05 ] [ -6.6e-06 2.1e-06 -8.5e-06 ] [ -8.5e-06 -3.7e-06 3.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.506046023552e-14 -2.931983216064e-14 -4.854595161024e-14 ] [ -1.169588933184e-14 -3.268440306432e-14 -2.275090801536e-14 ] [ 1.233675998016e-14 -2.755743787776e-14 1.634220153216e-14 ] [ -7.2097947936e-15 5.944075263168e-14 3.957376253376001e-14 ] [ 1.554111322176e-14 3.268440306432e-14 -2.098851373248e-14 ] [ -1.057436569728e-14 3.36457090368e-15 -1.36185012768e-14 ] [ -1.36185012768e-14 -5.928053496960001e-15 5.014812823104e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.53667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.450554916388474e-18 } }