{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.3697097 -14.3650676 -6.0471169 ] [ -21.1824952 6.8384479 2.5227496 ] [ -3.9827043 -2.954479 19.6852368 ] [ 13.9018106 2.4673955 2.1292029 ] [ 17.6330985 8.0137032 -18.2900724 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.020539996262298e-08 -2.301537546493157e-08 -9.68854932042457e-09 ] [ -3.393809857964822e-08 1.095640134793886e-08 4.041890429252552e-09 ] [ -6.38099571701963e-09 -4.733597180444564e-09 3.15392261758718e-08 ] [ 2.227315593010962e-08 3.953203384367126e-09 3.411359107319561e-09 ] [ 2.825133816896355e-08 1.283936791307015e-08 -2.930392639201935e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.2357207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.78637267777861e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9269161 -0.0393387 1.183993 ] [ 0.0492861 2.3481688 0.9065592 ] [ 1.062509 1.6597732 3.1530776 ] [ 3.1339502 1.1255763 1.749109 ] [ 2.3498941 2.9140375 0.2598281 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.269161e-11 -3.93387e-12 1.183993e-10 ] [ 4.92861e-12 2.3481688e-10 9.065592000000001e-11 ] [ 1.062509e-10 1.6597732e-10 3.1530776e-10 ] [ 3.1339502e-10 1.1255763e-10 1.749109e-10 ] [ 2.3498941e-10 2.9140375e-10 2.598281e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.43e-05 -2.87e-05 -3e-07 ] [ -4.18e-05 -2.33e-05 -1.88e-05 ] [ 6.9e-06 1.59e-05 2.74e-05 ] [ 6.6e-06 3.9e-05 -4.77e-05 ] [ 6.26e-05 -2.9e-06 3.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.495465809344e-14 -4.598246901696e-14 -4.8065298624e-16 ] [ -6.697098274944e-14 -3.733071526464e-14 -3.012092047104e-14 ] [ 1.105501868352e-14 2.547460827072e-14 4.389963940992e-14 ] [ 1.057436569728e-14 6.248488821120001e-14 -7.642382481215999e-14 ] [ 1.0029625646208e-13 -4.646312200320001e-15 6.312575885952001e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.977047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758716806882278e-18 } }