{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5150987 -2.391805 -3.9908303 ] [ -4.5524049 -2.0194068 11.340196 ] [ -7.0767262 3.2801197 -0.998378 ] [ 0.2274371 -16.4220364 -0.5680795 ] [ 4.4296258 1.8124969 -9.7482012 ] [ -0.2191371 14.5806489 -1.3822054 ] [ 11.7063041 1.1599828 5.3474984 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.233985577744473e-09 -3.832094052512545e-09 -6.39401500424025e-09 ] [ -7.293756699195363e-09 -3.235446362844541e-09 1.816899690648968e-08 ] [ -1.133816526944282e-08 5.255331096765511e-09 -1.599577890321062e-09 ] [ 3.643944043225517e-10 -2.63110027860066e-08 -9.101636936557536e-10 ] [ 7.097042895652498e-09 2.903940158452476e-09 -1.561834005749451e-08 ] [ -3.510963383699117e-10 2.336077478367324e-08 -2.214537177023512e-09 ] [ 1.875556674499519e-08 1.858497322690122e-09 8.567636916245406e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7649195 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.032066002094026e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2578888 2.4068332 1.7132531 ] [ 2.8398807 2.6072051 4.8503355 ] [ 1.4250396 3.8687642 3.4798823 ] [ 2.6330566 0.8566801 3.3713467 ] [ 4.1652958 3.7551209 1.8372371 ] [ 2.8463008 5.4658061 2.6299134 ] [ 4.8333697 3.2159964 3.9424489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2578888e-10 2.4068332e-10 1.7132531e-10 ] [ 2.8398807e-10 2.6072051e-10 4.8503355e-10 ] [ 1.4250396e-10 3.8687642e-10 3.4798823e-10 ] [ 2.6330566e-10 8.566801000000001e-11 3.3713467e-10 ] [ 4.1652958e-10 3.7551209e-10 1.8372371e-10 ] [ 2.8463008e-10 5.4658061e-10 2.6299134e-10 ] [ 4.833369700000001e-10 3.2159964e-10 3.9424489e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 2.2e-06 -2.5e-06 ] [ 1.18e-05 3.1e-06 2.86e-05 ] [ -1.68e-05 1.06e-05 -1.23e-05 ] [ 1.53e-05 -3.8e-06 -9.3e-06 ] [ -3.2e-06 9.4e-06 3.4e-06 ] [ -1.8e-06 4e-06 -1.34e-05 ] [ 2.4e-06 -2.55e-05 5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233675998016e-14 3.52478856576e-15 -4.005441552e-15 ] [ 1.890568412544e-14 4.96674752448e-15 4.582225135488e-14 ] [ -2.691656722944e-14 1.698307218048e-14 -1.970677243584e-14 ] [ 2.451330229824e-14 -6.08827115904e-15 -1.490024257344e-14 ] [ -5.126965186560001e-15 1.506046023552e-14 5.44740051072e-15 ] [ -2.88391791744e-15 6.4087064832e-15 -2.146916671872e-14 ] [ 3.84522388992e-15 -4.08555038304e-14 8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }