{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4202761 1.5690124 2.6700533 ] [ 1.6125021 -1.0783276 -0.2885972 ] [ -0.2871908 2.5880996 -0.7100491 ] [ -1.5102788 1.1941701 -1.7174224 ] [ -1.2353086 -4.2729545 0.0460155 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.275533162501003e-09 2.513834985025298e-09 4.277896973549889e-09 ] [ 2.583513165610903e-09 -1.727671270283374e-09 -4.623836866683418e-10 ] [ -4.601303854688487e-10 4.146592671421832e-09 -1.137624067640081e-09 ] [ -2.419733384249879e-09 1.913271415478398e-09 -2.751614017318226e-09 ] [ -1.979182558393179e-09 -6.846027801642154e-09 7.37249582944224e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -15.460746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.477084578132712e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8326068 2.6510622 1.0235517 ] [ 1.173946 1.5687574 3.0832369 ] [ 0.6609094 3.911004 2.7698732 ] [ 2.471277 4.9276461 1.5303005 ] [ 2.9743174 3.1825362 3.1268826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8326068e-10 2.6510622e-10 1.0235517e-10 ] [ 1.173946e-10 1.5687574e-10 3.0832369e-10 ] [ 6.609094e-11 3.911004e-10 2.7698732e-10 ] [ 2.471277e-10 4.9276461e-10 1.5303005e-10 ] [ 2.9743174e-10 3.1825362e-10 3.1268826e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-06 3.4e-06 -1.77e-05 ] [ -3.6e-06 -1.22e-05 9.2e-06 ] [ 1.57e-05 1.24e-05 -3e-07 ] [ -8.3e-06 -2.06e-05 1.58e-05 ] [ -9.3e-06 1.7e-05 -7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-15 5.44740051072e-15 -2.835852618816e-14 ] [ -5.76783583488e-15 -1.954655477376e-14 1.474002491136e-14 ] [ 2.515417294656e-14 1.986699009792e-14 -4.8065298624e-16 ] [ -1.329806595264e-14 -3.300483838848e-14 2.531439060864e-14 ] [ -1.490024257344e-14 2.72370025536e-14 -1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }