{ "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" [ [ 2.723222 4.526694 1.360574 ] [ 2.417536 3.174257 3.140142 ] [ 3.174903 0.8317717 2.605725 ] [ 4.479997 2.361559 1.640517 ] [ 3.774403 1.830324 4.619346 ] [ 4.138625 4.139223 3.615344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.723222e-10 4.526694e-10 1.360574e-10 ] [ 2.417536e-10 3.174257e-10 3.140142e-10 ] [ 3.174903e-10 8.317717e-11 2.605725e-10 ] [ 4.479997e-10 2.361559e-10 1.640517e-10 ] [ 3.774403e-10 1.830324e-10 4.619346e-10 ] [ 4.138625e-10 4.139223000000001e-10 3.615344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6053278 0.0741224 -0.5902487 ] [ -4.7137474 -1.2152398 0.4240453 ] [ -0.7625812 -1.3871333 -0.1324522 ] [ 1.4885285 1.0742878 -1.7512912 ] [ 0.4718414 0.3304306 1.2526927 ] [ 2.9106309 1.1235322 0.7972541 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.698420570706252e-10 1.187571773360016e-10 -9.456826753888756e-10 ] [ -7.55225594285825e-09 -1.947028812266833e-09 6.793954714175201e-10 ] [ -1.221789780167681e-09 -2.222432561503312e-09 -2.122118199618948e-10 ] [ 2.384885581743069e-09 1.721198811351265e-09 -2.80587783996982e-09 ] [ 7.559732660338476e-10 5.294081864786004e-10 2.007034973522372e-09 ] [ 4.663344818178391e-09 1.800097038386615e-09 1.277341890380699e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.405515719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.147800405206618e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.926603 4.2340616 1.8215575 ] [ 1.6655803 2.818271 3.1904431 ] [ 3.2788876 1.123059 2.5536175 ] [ 4.6298581 2.578607 1.3070179 ] [ 3.4965352 2.2849404 4.6969324 ] [ 4.7112216 3.8248898 3.4120796 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.926603e-10 4.2340616e-10 1.8215575e-10 ] [ 1.6655803e-10 2.818271e-10 3.1904431e-10 ] [ 3.2788876e-10 1.123059e-10 2.5536175e-10 ] [ 4.6298581e-10 2.578607e-10 1.3070179e-10 ] [ 3.4965352e-10 2.2849404e-10 4.6969324e-10 ] [ 4.7112216e-10 3.8248898e-10 3.4120796e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.08e-05 -3.84e-05 -4.08e-05 ] [ -1.18e-05 5.74e-05 2.09e-05 ] [ 1.39e-05 -1.19e-05 -1.82e-05 ] [ 1.84e-05 1.01e-05 -1.98e-05 ] [ -9e-07 -2.16e-05 1.74e-05 ] [ 2.12e-05 4.3e-06 4.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.53688066672e-14 -6.152358274559999e-14 -6.53688066672e-14 ] [ -1.89056842812e-14 9.196493879159998e-14 3.34854916506e-14 ] [ 2.22702552126e-14 -1.90659019446e-14 -2.915961473879999e-14 ] [ 2.94800500656e-14 1.61819840034e-14 -3.17230973532e-14 ] [ -1.4419589706e-15 -3.46070152944e-14 2.78778734316e-14 ] [ 3.39661446408e-14 6.8893595262e-15 6.4888153677e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.509304719227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.64508222647324e-18 } }