{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6988119 0.0728568 -1.1985098 ] [ -2.3692057 0.1461512 0.5017957 ] [ -5.1454216 -2.2515784 -3.3511899 ] [ -0.7009624 -0.92558 8.5110208 ] [ 4.5861019 0.5633689 1.7192669 ] [ 4.5460112 9.2557695 -1.5969374 ] [ 0.7822885 -6.8609882 -4.5854464 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.721796731741144e-09 1.167294625880112e-10 -1.920224397180013e-09 ] [ -3.795886013679614e-09 2.341600376710608e-10 8.039653455816736e-10 ] [ -8.243874259598893e-09 -3.607426302099105e-09 -5.369198153876796e-09 ] [ -1.123065578592562e-09 -1.48294264889772e-09 1.363615865724799e-08 ] [ 7.347745305323005e-09 9.026164879022825e-10 2.754569254789614e-09 ] [ 7.2835129225423e-09 1.482937762258986e-08 -2.558575788240711e-09 ] [ 1.253364355746909e-09 -1.099251498018972e-08 -7.346695078539417e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.413894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.66848976357528e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6847748 0.971655 1.9297404 ] [ 2.0851345 2.5454986 3.6101927 ] [ 1.8567979 4.1918337 1.4552586 ] [ 2.7136396 4.2643841 3.8881357 ] [ 4.878615 2.6631576 3.4906607 ] [ 3.6402522 5.997308 1.9568845 ] [ 3.320377 2.6307276 0.430033 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6847748e-10 9.716550000000001e-11 1.9297404e-10 ] [ 2.0851345e-10 2.5454986e-10 3.6101927e-10 ] [ 1.8567979e-10 4.1918337e-10 1.4552586e-10 ] [ 2.7136396e-10 4.2643841e-10 3.8881357e-10 ] [ 4.878615e-10 2.6631576e-10 3.4906607e-10 ] [ 3.6402522e-10 5.997308e-10 1.9568845e-10 ] [ 3.320377e-10 2.6307276e-10 4.30033e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.91e-05 2.68e-05 6.69e-05 ] [ 4.67e-05 -0.0003743 -0.0001278 ] [ -2.9e-05 -4.42e-05 -2.5e-05 ] [ 0.0002181 0.0003552 3.33e-05 ] [ -0.0001428 -5.23e-05 8.66e-05 ] [ -5.16e-05 4.31e-05 6e-06 ] [ 1.77e-05 4.57e-05 -4.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.468863906939999e-14 4.293833379119999e-14 1.071856168146e-13 ] [ 7.482164880779999e-14 -5.996947141062e-13 -2.047581738252e-13 ] [ -4.6463122386e-14 -7.08162072228e-14 -4.005441585e-14 ] [ 3.494347238754e-13 5.690931403968e-13 5.33524819122e-14 ] [ -2.287908233352e-13 -8.379383795819998e-14 1.387484965044e-13 ] [ -8.267231431439999e-14 6.90538129254e-14 9.613059803999999e-15 ] [ 2.83585264218e-14 7.32194721738e-14 -6.42472830234e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.618845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.662632514306773e-18 } }