{ "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" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0004442 0.0679933 0.2473602 ] [ -1.3890615 -1.2020239 0.4430254 ] [ 0.376908 -0.0086231 0.3216854 ] [ 0.3272554 0.4343012 -2.8554907 ] [ 0.0121239 -3.2293293 2.8486072 ] [ -1.1945848 2.8866918 -1.7106025 ] [ 1.8669149 1.05099 0.7054151 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.1168685495936e-13 1.089372756310406e-10 3.963147293564122e-10 ] [ -2.225521860153379e-09 -1.925854590222837e-09 7.098049383005683e-10 ] [ 6.038731857924864e-10 -1.381572921882048e-11 5.153968271326963e-10 ] [ 5.243209509105524e-10 6.95827229025385e-10 -4.575000440451826e-09 ] [ 1.942462913291712e-11 -5.173955905324429e-09 4.56397185768255e-09 ] [ -1.913935838123044e-09 4.624990113415069e-09 -2.740687332982032e-09 ] [ 2.99112740580317e-09 1.683871606694592e-09 1.130199581179294e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.704329 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.637634511475145e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9462245 1.1018088 2.0951358 ] [ 1.8844447 2.5642091 3.9390862 ] [ 1.6835411 3.1117575 1.5816095 ] [ 4.0823178 3.0442278 1.2087067 ] [ 3.9935893 1.4936285 4.1950504 ] [ 3.0204909 4.5067251 3.052806 ] [ 5.0948997 3.3767604 3.3357064 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9462245e-10 1.1018088e-10 2.0951358e-10 ] [ 1.8844447e-10 2.5642091e-10 3.9390862e-10 ] [ 1.6835411e-10 3.1117575e-10 1.5816095e-10 ] [ 4.0823178e-10 3.0442278e-10 1.2087067e-10 ] [ 3.9935893e-10 1.4936285e-10 4.195050400000001e-10 ] [ 3.0204909e-10 4.5067251e-10 3.052806e-10 ] [ 5.0948997e-10 3.376760400000001e-10 3.3357064e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.5e-06 5.18e-05 -6.9e-06 ] [ 5.02e-05 -7e-07 5.95e-05 ] [ 1.92e-05 -4.36e-05 -2.8e-06 ] [ 5.7e-06 2.93e-05 1.6e-05 ] [ -8.53e-05 -5.54e-05 4.2e-06 ] [ 5.9e-06 -1.62e-05 -4.28e-05 ] [ -2.3e-06 3.48e-05 -2.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.04141480352e-14 8.299274895744e-14 -1.105501868352e-14 ] [ 8.042926636416e-14 -1.12152363456e-15 9.532950893760001e-14 ] [ 3.076179111936e-14 -6.985490066688e-14 -4.48609453824e-15 ] [ 9.13240673856e-15 4.694377498944e-14 2.56348259328e-14 ] [ -1.3666566575424e-13 -8.876058479231999e-14 6.72914180736e-15 ] [ 9.45284206272e-15 -2.595526125696e-14 -6.857315937023999e-14 ] [ -3.68500622784e-15 5.575574640383999e-14 -4.357920408576e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }