{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.797173 1.880519 2.621604 ] [ 2.732492 2.231734 4.550403 ] [ 1.229923 3.945183 3.396256 ] [ 3.798537 2.960677 2.455754 ] [ 3.373455 4.934702 3.584472 ] [ 4.913806 3.358248 4.34106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.797173e-10 1.880519e-10 2.621604e-10 ] [ 2.732492e-10 2.231734e-10 4.550403000000001e-10 ] [ 1.229923e-10 3.945183e-10 3.396256e-10 ] [ 3.798537e-10 2.960677e-10 2.455754e-10 ] [ 3.373455e-10 4.934702e-10 3.584472e-10 ] [ 4.913806e-10 3.358248e-10 4.34106e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7326499 -4.5607637 -4.3256459 ] [ -1.3880386 -8.1439569 11.4200474 ] [ -7.9811264 5.7686113 0.9421373 ] [ 7.9742572 -2.3068439 -11.6268303 ] [ -0.4912204 9.6408211 -0.6094887 ] [ 5.6187782 -0.3978679 4.1997802 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.980364403411458e-09 -7.307148973133304e-09 -6.930448730839373e-09 ] [ -2.223882993687963e-09 -1.304805734598284e-08 1.829693295270783e-08 ] [ -1.278717412572967e-08 9.242334159342695e-09 1.509470355643636e-09 ] [ 1.277616845408607e-08 -3.695971364415093e-09 -1.862823568066905e-08 ] [ -7.870218405400244e-10 1.544629817173534e-08 -9.76508545781785e-10 ] [ 9.002275069500708e-09 -6.374546475467923e-10 6.728789648938748e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.378249 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.20819832544098e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8732498 2.0392425 2.8258258 ] [ 2.9719707 1.8153749 4.9803215 ] [ 1.194839 4.2818464 3.0875448 ] [ 4.0793154 2.5071011 1.9238624 ] [ 3.1348005 5.2590916 4.0115966 ] [ 4.5912106 3.4084064 4.120398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8732498e-10 2.0392425e-10 2.8258258e-10 ] [ 2.9719707e-10 1.8153749e-10 4.980321499999999e-10 ] [ 1.194839e-10 4.2818464e-10 3.0875448e-10 ] [ 4.0793154e-10 2.5071011e-10 1.9238624e-10 ] [ 3.1348005e-10 5.2590916e-10 4.0115966e-10 ] [ 4.5912106e-10 3.4084064e-10 4.120398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 7.2e-06 -8.4e-06 ] [ 5.5e-06 -7e-07 -1.88e-05 ] [ -4.7e-06 -5.6e-06 1.58e-05 ] [ 3.8e-06 -1.39e-05 1.71e-05 ] [ -7e-07 1.64e-05 -8.2e-06 ] [ -2.8e-06 -3.4e-06 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 1.153567166976e-14 -1.345828361472e-14 ] [ 8.8119714144e-15 -1.12152363456e-15 -3.012092047104e-14 ] [ -7.53023011776e-15 -8.972189076479999e-15 2.531439060864e-14 ] [ 6.08827115904e-15 -2.227025502912e-14 2.739722021568e-14 ] [ -1.12152363456e-15 2.627569658112e-14 -1.313784829056e-14 ] [ -4.48609453824e-15 -5.44740051072e-15 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.5540646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53072989357329e-18 } }