{ "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" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8250882 0.8123486 -0.9991073 ] [ -4.5257147 -0.2040079 2.0037426 ] [ -16.2385327 -0.1410019 3.0637147 ] [ 3.3609719 -7.0930495 -1.4304841 ] [ 1.0780013 -1.7269223 1.4055593 ] [ 13.6826254 5.5844091 -5.374862 ] [ 1.8175607 2.7682239 1.3314369 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.321937024137955e-09 1.301525934859611e-09 -1.600746357730612e-09 ] [ -7.250994284750885e-09 -3.268566878385043e-10 3.210349547821006e-09 ] [ -2.60169974480363e-08 -2.259099476683796e-10 4.908612065141285e-09 ] [ 5.384870601345755e-09 -1.136431807907713e-08 -2.291888181446129e-09 ] [ 1.727148480052007e-09 -2.766834534998164e-09 2.251954249608013e-09 ] [ 2.192198252704425e-08 8.947209701002771e-09 -8.61147823642633e-09 ] [ 2.912053260424882e-09 4.435183613719797e-09 2.133197073250427e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.202611 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.756162116091691e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4389839 1.2040544 1.4719213 ] [ 1.1347341 1.8635047 3.9000861 ] [ 1.3522688 3.6836584 1.9891028 ] [ 3.896652 1.137669 1.6884546 ] [ 3.5840142 1.2553782 4.1338235 ] [ 3.8648817 3.6054479 1.6664771 ] [ 3.0136173 3.7234082 4.0507715 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4389839e-10 1.2040544e-10 1.4719213e-10 ] [ 1.1347341e-10 1.8635047e-10 3.9000861e-10 ] [ 1.3522688e-10 3.6836584e-10 1.9891028e-10 ] [ 3.896652e-10 1.137669e-10 1.6884546e-10 ] [ 3.5840142e-10 1.2553782e-10 4.1338235e-10 ] [ 3.8648817e-10 3.6054479e-10 1.6664771e-10 ] [ 3.0136173e-10 3.7234082e-10 4.0507715e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 1.1e-05 3.8e-06 ] [ 6.1e-06 6e-06 -2.7e-06 ] [ -3e-06 -5.2e-06 -7.6e-06 ] [ 2.4e-06 -5.3e-06 -3e-07 ] [ 6.5e-06 -9e-06 6.2e-06 ] [ -2.7e-06 5e-06 -7e-07 ] [ -6.2e-06 -2.6e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-15 1.76239428288e-14 6.08827115904e-15 ] [ 9.77327738688e-15 9.6130597248e-15 -4.32587687616e-15 ] [ -4.8065298624e-15 -8.33131842816e-15 -1.217654231808e-14 ] [ 3.84522388992e-15 -8.491536090240001e-15 -4.8065298624e-16 ] [ 1.04141480352e-14 -1.44195895872e-14 9.93349504896e-15 ] [ -4.32587687616e-15 8.010883104e-15 -1.12152363456e-15 ] [ -9.93349504896e-15 -4.16565921408e-15 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }