{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1522401 0.6146856 -2.9149425 ] [ -2.5534806 2.1781243 1.366094 ] [ -1.9647438 -2.2367016 0.4825125 ] [ 0.3271983 -2.9894786 -0.9631656 ] [ 0.4858061 0.0880129 -0.0781328 ] [ 3.1264249 -0.9968535 1.6758382 ] [ 1.7310351 3.342211 0.4317962 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.846092149768254e-09 9.848348974624205e-10 -4.670252724476304e-09 ] [ -4.091126918986357e-09 3.489739830656365e-09 2.188723868615155e-09 ] [ -3.147866582221751e-09 -3.583591011225953e-09 7.730702467437601e-10 ] [ 5.242294666255047e-10 -4.789672721301915e-09 -1.543161406278805e-09 ] [ 7.783471756620269e-10 1.410122107088083e-10 -1.251825454776423e-10 ] [ 5.009084881466978e-09 -1.597135372062653e-09 2.684988784283555e-09 ] [ 2.77342396700419e-09 5.354812325980589e-09 6.91813776590281e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.989826 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.722070200865998e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4997088 1.1677325 1.0285439 ] [ 2.0832879 3.1754062 4.7767459 ] [ 1.3834889 0.9555467 4.1517593 ] [ 3.310177 0.0609391 3.1106909 ] [ 4.1995074 3.3875989 1.6535195 ] [ 5.058425 1.0460266 4.3621733 ] [ 4.320411 3.2655596 4.0129192 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4997088e-10 1.1677325e-10 1.0285439e-10 ] [ 2.0832879e-10 3.1754062e-10 4.7767459e-10 ] [ 1.3834889e-10 9.555467e-11 4.1517593e-10 ] [ 3.310177e-10 6.09391e-12 3.1106909e-10 ] [ 4.1995074e-10 3.3875989e-10 1.6535195e-10 ] [ 5.058425e-10 1.0460266e-10 4.3621733e-10 ] [ 4.320411e-10 3.2655596e-10 4.0129192e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-05 4.81e-05 -3.89e-05 ] [ 8.6e-06 2.2e-06 -2.8e-06 ] [ 1.85e-05 7.1e-06 1.09e-05 ] [ 2.21e-05 7.6e-06 3.8e-05 ] [ -1.64e-05 -2.71e-05 1.7e-06 ] [ -3.31e-05 -3.7e-06 9.1e-06 ] [ -1.38e-05 -3.41e-05 -1.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.24304726912e-14 7.706469546047999e-14 -6.232467054911999e-14 ] [ 1.377871893888e-14 3.52478856576e-15 -4.48609453824e-15 ] [ 2.96402674848e-14 1.137545400768e-14 1.746372516672e-14 ] [ 3.540810331968e-14 1.217654231808e-14 6.08827115904e-14 ] [ -2.627569658112e-14 -4.341898642368e-14 2.72370025536e-15 ] [ -5.303204614848e-14 -5.928053496960001e-15 1.457980724928e-14 ] [ -2.211003736704e-14 -5.463422276928e-14 -2.867896151232001e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }