{ "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" [ [ 0.3085936 0.1786623 -2.0283273 ] [ -4.0457741 0.2843881 2.4372609 ] [ -7.2913089 0.9724028 0.0570362 ] [ 3.2654495 -5.2218144 -2.6561652 ] [ 1.5751194 -1.9496549 2.7448389 ] [ 4.901241 3.573527 -3.3976459 ] [ 1.2866794 2.1624892 2.8430025 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.944214512485069e-10 2.862485600783558e-10 -3.249738579390388e-09 ] [ -6.482044676058161e-09 4.556399650537325e-10 3.904922432769967e-09 ] [ -1.168196465461097e-08 1.557961032160458e-09 9.138206617927297e-11 ] [ 5.23182684530305e-09 -8.366268949836782e-09 -4.255645784422556e-09 ] [ 2.523619477648524e-09 -3.123691499408162e-09 4.397716713442389e-09 ] [ 7.852653743106413e-09 5.725421413197562e-09 -5.443628826736975e-09 ] [ 2.061487653144971e-09 3.464689638972495e-09 4.554992138375953e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.120164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.262299664266181e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4126315 1.0888635 1.4855128 ] [ 1.2785944 2.1703762 3.786854 ] [ 1.1916598 3.5770647 1.6520823 ] [ 3.8489782 1.2483461 1.7029272 ] [ 3.5679777 1.1111658 4.1341144 ] [ 3.6458229 3.6780288 1.8477576 ] [ 3.3394874 3.5992758 4.2913887 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4126315e-10 1.0888635e-10 1.4855128e-10 ] [ 1.2785944e-10 2.1703762e-10 3.786854e-10 ] [ 1.1916598e-10 3.5770647e-10 1.6520823e-10 ] [ 3.8489782e-10 1.2483461e-10 1.7029272e-10 ] [ 3.5679777e-10 1.1111658e-10 4.1341144e-10 ] [ 3.6458229e-10 3.6780288e-10 1.8477576e-10 ] [ 3.3394874e-10 3.5992758e-10 4.2913887e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.9e-06 -1.25e-05 1.77e-05 ] [ 1.01e-05 3e-05 -7.5e-06 ] [ 2.23e-05 -4.94e-05 -4.98e-05 ] [ -6.7e-05 4.85e-05 2.62e-05 ] [ 2.04e-05 -5.25e-05 -5.62e-05 ] [ -5.7e-06 -7e-06 5.68e-05 ] [ 1.49e-05 4.3e-05 1.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.850665441919999e-15 -2.002720776e-14 2.835852618816e-14 ] [ 1.618198387008e-14 4.8065298624e-14 -1.2016324656e-14 ] [ 3.572853864384e-14 -7.914752506752001e-14 -7.978839571583999e-14 ] [ -1.073458335936e-13 7.77055661088e-14 4.197702746496e-14 ] [ 3.268440306432e-14 -8.4114272592e-14 -9.004232608896e-14 ] [ -9.13240673856e-15 -1.12152363456e-14 9.100363206143999e-14 ] [ 2.387243164992e-14 6.889359469439999e-14 2.050786074624e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.305811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.932914240898347e-18 } }