{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1109271 -0.5374135 0.4756039 ] [ -4.6148809 5.6472078 -1.1568251 ] [ -1.0068036 -0.1338593 0.9721329 ] [ 2.5537455 -4.1791164 -2.1759614 ] [ 2.9570119 -0.7968185 1.8850497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.777248076973814e-10 -8.610313524961589e-10 7.620014556192726e-10 ] [ -7.39385434667289e-09 9.047824384502546e-09 -1.853438144844713e-09 ] [ -1.613077202947082e-09 -2.144662427035962e-10 1.557528617522658e-09 ] [ 4.091551369282646e-09 -6.695682646846197e-09 -3.486274511565927e-09 ] [ 4.737655372639944e-09 -1.276643982238929e-09 3.020182583268709e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.107992 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.939914186705893e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5737381 1.8831107 2.2341311 ] [ 2.8425496 4.2000236 1.1125212 ] [ 2.5608622 3.9704904 3.5569288 ] [ 4.2043362 2.2591277 0.4156464 ] [ 4.73151 3.2613455 2.6121879 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5737381e-10 1.8831107e-10 2.2341311e-10 ] [ 2.8425496e-10 4.2000236e-10 1.1125212e-10 ] [ 2.5608622e-10 3.9704904e-10 3.5569288e-10 ] [ 4.2043362e-10 2.2591277e-10 4.156464000000001e-11 ] [ 4.731510000000001e-10 3.2613455e-10 2.6121879e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.96e-05 1.92e-05 -9e-07 ] [ -1.7e-06 -4.08e-05 5.1e-06 ] [ 9.6e-06 2.06e-05 -3.28e-05 ] [ -2.4e-05 5.66e-05 3.39e-05 ] [ -3.36e-05 -5.57e-05 -5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.94679610464e-14 3.076179137279999e-14 -1.4419589706e-15 ] [ -2.7237002778e-15 -6.53688066672e-14 8.1711008334e-15 ] [ 1.53808956864e-14 3.300483866039999e-14 -5.255139359519999e-14 ] [ -3.8452239216e-14 9.06831974844e-14 5.431378789259999e-14 ] [ -5.383313490239999e-14 -8.924123851379999e-14 -8.4915361602e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.399219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.146791559564885e-18 } }