{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4570891 -0.8734719 1.3183257 ] [ -2.9585026 -1.3646774 -1.0363812 ] [ -0.6067253 -0.6090303 -1.6718447 ] [ 0.219787 -1.5620052 1.5323719 ] [ 0.4209736 -0.6229697 -1.0376428 ] [ 2.2645652 2.6293947 -0.5409891 ] [ 2.1169912 2.4027598 1.4361601 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.334514090442513e-09 -1.399456257105756e-09 2.112190615139794e-09 ] [ -4.740043698296014e-09 -2.18645422521413e-09 -1.660465728876649e-09 ] [ -9.720810909078662e-10 -9.757741080188103e-10 -2.67859049194839e-09 ] [ 3.521375929557696e-10 -2.502608213008028e-09 2.455130432550876e-09 ] [ 6.744740598940109e-10 -9.981074888067897e-10 -1.66248703490145e-09 ] [ 3.628233419717276e-09 4.21275471519543e-09 -8.667600881276333e-10 ] [ 3.391793807079337e-09 3.849645576958084e-09 2.30098213594579e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.164726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.551180580363791e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0855461 2.2835997 1.6627258 ] [ 2.9558565 1.3198139 3.8959672 ] [ 1.3376182 4.6666104 1.8124663 ] [ 2.0116731 3.7207677 4.0286775 ] [ 4.6151561 1.9552519 2.0712919 ] [ 3.8158547 4.4116919 2.0446923 ] [ 4.5472202 3.2770174 4.247255 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0855461e-10 2.2835997e-10 1.6627258e-10 ] [ 2.9558565e-10 1.3198139e-10 3.8959672e-10 ] [ 1.3376182e-10 4.6666104e-10 1.8124663e-10 ] [ 2.0116731e-10 3.7207677e-10 4.0286775e-10 ] [ 4.6151561e-10 1.9552519e-10 2.0712919e-10 ] [ 3.8158547e-10 4.4116919e-10 2.0446923e-10 ] [ 4.5472202e-10 3.2770174e-10 4.247255e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.46e-05 -3.21e-05 -2.02e-05 ] [ -8.6e-06 -3.05e-05 4.6e-06 ] [ -1.9e-05 2.97e-05 -1.56e-05 ] [ -9.3e-06 1.3e-05 3.23e-05 ] [ 3.01e-05 -9.6e-06 -1.01e-05 ] [ 1.02e-05 2.21e-05 -2.34e-05 ] [ 2.11e-05 7.4e-06 3.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.941354487168e-14 -5.142986952768e-14 -3.236396774016e-14 ] [ -1.377871893888e-14 -4.88663869344e-14 7.370012455680001e-15 ] [ -3.04413557952e-14 4.758464563776e-14 -2.499395528448e-14 ] [ -1.490024257344e-14 2.08282960704e-14 5.175030485184e-14 ] [ 4.822551628608e-14 -1.538089555968e-14 -1.618198387008e-14 ] [ 1.634220153216e-14 3.540810331968e-14 -3.749093292672001e-14 ] [ 3.380592669888e-14 1.185610699392e-14 5.175030485184e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }