{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6800483 -5.7466756 -2.2164341 ] [ -6.2048748 -0.9491369 6.2150107 ] [ -7.6296374 4.0893941 -5.6951295 ] [ -0.534707 8.2314502 4.6658974 ] [ 3.6195717 -5.9572039 -8.8462197 ] [ 9.4394506 -5.4783327 8.4667454 ] [ 7.990245 5.8105048 -2.5898702 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.070261721207478e-08 -9.207189293641812e-09 -3.551118896563889e-09 ] [ -9.941305339551076e-09 -1.520684951118588e-09 9.957544841561841e-09 ] [ -1.22240266674613e-08 6.551931620257457e-09 -9.124603337328394e-09 ] [ -8.566950543781057e-10 1.318823706571948e-08 7.475591729331508e-09 ] [ 5.799193155049311e-09 -9.544492813918582e-09 -1.417320638580039e-08 ] [ 1.512366706451653e-08 -8.777256572904141e-09 1.356522153414595e-08 ] [ 1.28017837334641e-08 9.309454945606181e-09 -4.14942948534662e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.973867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.078642638876863e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5605439 1.5390011 2.7820233 ] [ 2.3847237 2.2549217 4.9534838 ] [ 2.2608056 3.6863512 1.7097132 ] [ 2.6103722 4.4991502 4.0481994 ] [ 3.8629136 1.5463304 1.8071629 ] [ 4.6385053 1.7900484 4.171569 ] [ 4.6921887 3.884639 2.8073054 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5605439e-10 1.5390011e-10 2.7820233e-10 ] [ 2.3847237e-10 2.2549217e-10 4.9534838e-10 ] [ 2.2608056e-10 3.6863512e-10 1.7097132e-10 ] [ 2.6103722e-10 4.4991502e-10 4.0481994e-10 ] [ 3.8629136e-10 1.5463304e-10 1.8071629e-10 ] [ 4.6385053e-10 1.7900484e-10 4.171569e-10 ] [ 4.6921887e-10 3.884639e-10 2.8073054e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.97e-05 -1.71e-05 9.2e-06 ] [ 5.2e-06 -8e-06 -2.26e-05 ] [ -1.57e-05 -1.83e-05 -1.94e-05 ] [ 7.1e-06 8.3e-06 2.6e-06 ] [ -1.41e-05 1.6e-06 -6.9e-06 ] [ 1.33e-05 9.3e-06 5.8e-06 ] [ 4.38e-05 2.41e-05 3.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.360641184576e-14 -2.739722021568e-14 1.474002491136e-14 ] [ 8.33131842816e-15 -1.28174129664e-14 -3.620919163008e-14 ] [ -2.515417294656e-14 -2.931983216064e-14 -3.108222644352e-14 ] [ 1.137545400768e-14 1.329806595264e-14 4.16565921408e-15 ] [ -2.259069035328e-14 2.56348259328e-15 -1.105501868352e-14 ] [ 2.130894905664e-14 1.490024257344e-14 9.292624400640001e-15 ] [ 7.017533599104001e-14 3.861245656128e-14 5.014812823104e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }