{ "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" [ [ 1.8213481 3.7490563 0.4553767 ] [ -3.8920313 0.9919645 -0.4660744 ] [ -4.0160405 -2.8785036 0.5705805 ] [ 0.6733222 -3.2837935 -2.2676828 ] [ 2.234648 -5.2468698 2.7934246 ] [ 2.7331644 2.5764549 -3.9385881 ] [ 0.445589 4.0916912 2.8529634 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.918121344158501e-09 6.006650353922951e-09 7.295939023970554e-10 ] [ -6.235721556281831e-09 1.589302330563562e-09 -7.467335072333876e-10 ] [ -6.434406197285942e-09 -4.611871170808635e-09 9.141707373843745e-10 ] [ 1.078781087105622e-09 -5.261217173235004e-09 -3.633228365550283e-09 ] [ 3.580300781317479e-09 -8.406412125941572e-09 4.475559586087591e-09 ] [ 4.37901210248286e-09 4.127935805325602e-09 -6.310313772781092e-09 ] [ 7.139122782856512e-10 6.555611980173097e-09 4.570951259478079e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.628736 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.785740839825531e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7535963 1.3147967 1.607416 ] [ 1.0734132 2.0170316 3.9475332 ] [ 1.2821718 3.7498915 2.1365818 ] [ 4.1556456 1.5353252 2.0952754 ] [ 3.2134934 0.7841159 4.2889993 ] [ 3.5745788 3.7815531 1.1565533 ] [ 3.2322529 3.2904068 3.668278 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7535963e-10 1.3147967e-10 1.607416e-10 ] [ 1.0734132e-10 2.0170316e-10 3.9475332e-10 ] [ 1.2821718e-10 3.7498915e-10 2.1365818e-10 ] [ 4.1556456e-10 1.5353252e-10 2.0952754e-10 ] [ 3.2134934e-10 7.841159e-11 4.2889993e-10 ] [ 3.5745788e-10 3.7815531e-10 1.1565533e-10 ] [ 3.2322529e-10 3.2904068e-10 3.668278e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.76e-05 1.21e-05 -3e-06 ] [ 6.7e-05 -6.58e-05 5.81e-05 ] [ -7.02e-05 5.82e-05 -7.1e-05 ] [ 3.14e-05 -6.73e-05 -5.41e-05 ] [ -8.46e-05 3.59e-05 3.86e-05 ] [ -9.9e-06 3.62e-05 1.49e-05 ] [ 2.87e-05 -9.2e-06 1.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.024184094208e-14 1.938633711168e-14 -4.8065298624e-15 ] [ 1.073458335936e-13 -1.0542322164864e-13 9.308646166848001e-14 ] [ -1.1247279878016e-13 9.324667933055999e-14 -1.137545400768e-13 ] [ 5.030834589312e-14 -1.0782648657984e-13 -8.667775518528e-14 ] [ -1.3554414211968e-13 5.751814068672e-14 6.184401756288e-14 ] [ -1.586154854592e-14 5.799879367296e-14 2.387243164992e-14 ] [ 4.598246901696e-14 -1.474002491136e-14 2.64359142432e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.960863 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.159388775439175e-18 } }