{ "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" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4603457 -0.9868002 -1.9675997 ] [ -4.0163036 -0.0838384 1.5334088 ] [ -3.0439401 2.027202 -1.603206 ] [ 3.5639469 -5.2150199 -4.0209489 ] [ 1.8238683 -1.1098506 1.2086364 ] [ 0.2215449 0.7019892 0.2872733 ] [ 1.9112293 4.6663179 4.5624361 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.375551180258106e-10 -1.581028209840764e-09 -3.152442238433094e-09 ] [ -6.434827729954874e-09 -1.343239244052787e-10 2.456791729488983e-09 ] [ -4.876929663335614e-09 3.247935650039002e-09 -2.568619171526285e-09 ] [ 5.710072400952635e-09 -8.355382960786754e-09 -6.442270321011476e-09 ] [ 2.922159149678241e-09 -1.778176683900853e-09 1.936448983127877e-09 ] [ 3.549540592374739e-10 1.124710684294095e-09 4.602625650400647e-10 ] [ 3.06212690144795e-09 7.476265444600553e-09 7.309828453313932e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.023292 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246779058905168e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4404292 0.9452144 1.1223611 ] [ 1.1269357 2.1665744 3.904572 ] [ 1.2003535 3.4107618 1.8032801 ] [ 3.8505138 1.2547141 1.7588148 ] [ 3.3647896 1.2129779 4.1315051 ] [ 3.6010171 3.7318888 1.8351671 ] [ 3.701113 3.7509893 4.3449369 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4404292e-10 9.452144e-11 1.1223611e-10 ] [ 1.1269357e-10 2.1665744e-10 3.904572e-10 ] [ 1.2003535e-10 3.4107618e-10 1.8032801e-10 ] [ 3.8505138e-10 1.2547141e-10 1.7588148e-10 ] [ 3.3647896e-10 1.2129779e-10 4.1315051e-10 ] [ 3.6010171e-10 3.7318888e-10 1.8351671e-10 ] [ 3.701113e-10 3.7509893e-10 4.344936900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.25e-05 -1.74e-05 6.66e-05 ] [ 1.4e-05 9.7e-06 -4.6e-06 ] [ 6e-06 4.79e-05 -1.64e-05 ] [ 5.3e-06 1.19e-05 -6.8e-06 ] [ -1.8e-05 -5.64e-05 -4.76e-05 ] [ -2.11e-05 -2.09e-05 1.7e-06 ] [ -1.87e-05 2.52e-05 7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.207074017599999e-14 -2.787787320192e-14 1.0670496294528e-13 ] [ 2.24304726912e-14 1.554111322176e-14 -7.370012455680001e-15 ] [ 9.6130597248e-15 7.674426013632e-14 -2.627569658112e-14 ] [ 8.491536090240001e-15 1.906590178752e-14 -1.089480102144e-14 ] [ -2.88391791744e-14 -9.036276141312001e-14 -7.626360715008e-14 ] [ -3.380592669888e-14 -3.348549137472e-14 2.72370025536e-15 ] [ -2.996070280896e-14 4.037485084416e-14 1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.714404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.9983780561006e-18 } }