{ "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" [ [ 0.0662807 0.8720519 0.0908129 ] [ 1.491471 1.392356 0.9155942 ] [ 0.0089195 1.355999 1.632084 ] [ 2.755779 1.093572 2.625507 ] [ 1.848544 2.519779 2.293479 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.62807e-12 8.720519e-11 9.08129e-12 ] [ 1.491471e-10 1.392356e-10 9.155942e-11 ] [ 8.919500000000001e-13 1.355999e-10 1.632084e-10 ] [ 2.755779e-10 1.093572e-10 2.625507e-10 ] [ 1.848544e-10 2.519779e-10 2.293479e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.7507527 -22.4175664 -48.8749979 ] [ 46.3833763 -3.3021071 -37.370548 ] [ -61.6922757 3.7442077 38.962905 ] [ 37.2434861 -24.397059 23.8179972 ] [ 5.816166 46.3725248 23.4646438 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.446160718554248e-08 -3.591690078131163e-08 -7.830637897702909e-08 ] [ 7.431436110162881e-08 -5.290558794997688e-09 -5.98742183120842e-08 ] [ -9.884192181048797e-08 5.99888204035934e-09 6.242545546945142e-08 ] [ 5.967064270650976e-08 -3.908839754607823e-08 3.816063826811987e-08 ] [ 9.318525187891852e-09 7.429697508202819e-08 3.759450371175967e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 59.695692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.56430420848776e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0674523 0.8467306 0.000945 ] [ 2.3995032 0.5737334 0.1392751 ] [ -0.6521932 1.9489508 1.9501374 ] [ 3.1211347 1.5071536 2.1739996 ] [ 1.2350971 2.3571895 3.2931199 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.745230000000001e-12 8.467306e-11 9.45e-14 ] [ 2.3995032e-10 5.737333999999999e-11 1.392751e-11 ] [ -6.521932e-11 1.9489508e-10 1.9501374e-10 ] [ 3.1211347e-10 1.5071536e-10 2.1739996e-10 ] [ 1.2350971e-10 2.3571895e-10 3.2931199e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.2e-06 5.9e-06 6e-06 ] [ 8.9e-06 -5.5e-06 6.2e-06 ] [ 1.5e-06 -1e-06 -1.08e-05 ] [ -8.8e-06 7.7e-06 -7.5e-06 ] [ 6.5e-06 -7.1e-06 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.313784829056e-14 9.45284206272e-15 9.6130597248e-15 ] [ 1.425937192512e-14 -8.8119714144e-15 9.93349504896e-15 ] [ 2.4032649312e-15 -1.6021766208e-15 -1.730350750464e-14 ] [ -1.409915426304e-14 1.233675998016e-14 -1.2016324656e-14 ] [ 1.04141480352e-14 -1.137545400768e-14 9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }