{ "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" [ [ 1.1554904 1.2499887 0.6987608 ] [ -0.2360188 -0.567873 -0.526956 ] [ -4.5888822 -0.1618706 0.689868 ] [ -0.131913 -2.7571162 -0.5598394 ] [ -0.0044698 0.300143 0.0229853 ] [ 3.4692561 1.2382338 -1.1196742 ] [ 0.3365374 0.6984944 0.7948555 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.85129970443884e-09 2.002702671404185e-09 1.119538217291505e-09 ] [ -3.781438034292711e-10 -9.098328441835584e-10 -8.442765833902848e-10 ] [ -7.35219977644527e-09 -2.593452909148685e-10 1.105290381038054e-09 ] [ -2.113479245795904e-10 -4.417387116468937e-09 -8.969615980826995e-10 ] [ -7.16140905965184e-12 4.808820974967744e-10 3.682651028207424e-11 ] [ 5.558361014987787e-09 1.983869245444343e-09 -1.793915826152943e-09 ] [ 5.391923543048179e-10 1.119111397439724e-09 1.273498899014295e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.374472 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.264350269954422e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4776951 1.1016159 1.4178671 ] [ 1.2368462 2.0586178 3.7383409 ] [ 1.25321 3.4672767 1.7380751 ] [ 3.7524558 1.3085451 1.8074232 ] [ 3.4360169 1.2670835 4.122815 ] [ 3.5539362 3.6749667 1.8853031 ] [ 3.5749919 3.5950151 4.1908127 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4776951e-10 1.1016159e-10 1.4178671e-10 ] [ 1.2368462e-10 2.0586178e-10 3.7383409e-10 ] [ 1.25321e-10 3.4672767e-10 1.7380751e-10 ] [ 3.7524558e-10 1.3085451e-10 1.8074232e-10 ] [ 3.4360169e-10 1.2670835e-10 4.122815e-10 ] [ 3.5539362e-10 3.6749667e-10 1.8853031e-10 ] [ 3.5749919e-10 3.5950151e-10 4.1908127e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.9e-06 -2.1e-06 3.04e-05 ] [ 3.37e-05 1.29e-05 -2e-07 ] [ -4.4e-06 4.89e-05 -6.3e-06 ] [ 1.66e-05 -3.6e-05 4e-07 ] [ 1.46e-05 2.3e-06 -8.4e-06 ] [ -9.9e-06 9.6e-06 -8.7e-06 ] [ -5.96e-05 -3.56e-05 -7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.425937192512e-14 -3.36457090368e-15 4.870616927232e-14 ] [ 5.399335212096e-14 2.066807840832e-14 -3.2043532416e-16 ] [ -7.04957713152e-15 7.834643675712001e-14 -1.009371271104e-14 ] [ 2.659613190528e-14 -5.76783583488e-14 6.408706483200001e-16 ] [ 2.339177866368e-14 3.68500622784e-15 -1.345828361472e-14 ] [ -1.586154854592e-14 1.538089555968e-14 -1.393893660096e-14 ] [ -9.548972659968001e-14 -5.703748770048e-14 -1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.30335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573390593551968e-18 } }