{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.886033 1.9098533 5.2402947 ] [ 14.0378152 -25.5809756 3.9893664 ] [ -6.5086972 24.5029571 -11.1127155 ] [ -30.2761888 -46.9415492 -53.1070316 ] [ 25.3139662 44.2217997 55.6379888 ] [ -4.4529284 1.8879147 -0.6479029 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.021758003552922e-09 3.059922331627792e-09 8.395877723614038e-09 ] [ 2.249105950585004e-08 -4.098524138124412e-08 6.391669630544697e-09 ] [ -1.042808257162122e-08 3.925806532952439e-08 -1.780453311438963e-08 ] [ -4.850780226193249e-08 -7.520865329200138e-08 -8.508684513061962e-08 ] [ 4.055744515950577e-08 7.08511341927682e-08 8.914188561811369e-08 ] [ -7.134377835355006e-09 3.02477281932512e-09 -1.038054887480838e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.602319 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.771551330014246e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2135959 0.8414688 0.669935 ] [ 0.9420399 0.7993925 2.9189864 ] [ -0.2229644 2.6784363 2.021961 ] [ 2.2468931 -0.1463131 1.1887742 ] [ 3.3228286 0.9558836 2.9267425 ] [ 2.0703082 2.704407 2.1241998 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.135959e-11 8.414688000000001e-11 6.69935e-11 ] [ 9.420399000000001e-11 7.993925e-11 2.9189864e-10 ] [ -2.229644e-11 2.6784363e-10 2.021961e-10 ] [ 2.2468931e-10 -1.463131e-11 1.1887742e-10 ] [ 3.3228286e-10 9.558836000000001e-11 2.9267425e-10 ] [ 2.0703082e-10 2.704407e-10 2.1241998e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.51e-05 2.62e-05 7e-06 ] [ 2.64e-05 1.58e-05 6.2e-06 ] [ 9.1e-06 -4.5e-06 2.9e-05 ] [ -5.2e-06 5.94e-05 2.5e-06 ] [ -2.17e-05 -1.39e-05 3.39e-05 ] [ -4.37e-05 -8.31e-05 -7.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.62363998534e-14 4.197702781079999e-14 1.1215236438e-14 ] [ 4.22974631376e-14 2.53143908172e-14 9.9334951308e-15 ] [ 1.45798073694e-14 -7.209794853e-15 4.6463122386e-14 ] [ -8.331318496799998e-15 9.51692920596e-14 4.005441585e-15 ] [ -3.476723295779999e-14 -2.22702552126e-14 5.431378789259999e-14 ] [ -7.001511890579999e-14 -1.331408782854e-13 -1.25770865769e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.220473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.880547590502788e-18 } }