{ "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" [ [ 1.040169 0.3467498 1.049872 ] [ 0.0600036 1.405044 1.572488 ] [ 2.420904 2.65585 0.1683769 ] [ 1.553585 1.595169 0.3590691 ] [ 2.059971 2.654503 2.612695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.040169e-10 3.467498e-11 1.049872e-10 ] [ 6.00036e-12 1.405044e-10 1.572488e-10 ] [ 2.420904e-10 2.65585e-10 1.683769e-11 ] [ 1.553585e-10 1.595169e-10 3.590691e-11 ] [ 2.059971e-10 2.654503e-10 2.612695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 20.7041047 -146.7709226 30.3386362 ] [ -104.2760407 48.5498193 71.4358483 ] [ 149.2380471 173.3645551 -13.6602382 ] [ -69.6647185 -81.6683063 -92.9408956 ] [ 3.9986074 6.5248544 4.8266493 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.317163277822958e-08 -2.351529427403425e-07 4.860785402706655e-08 ] [ -1.67068635895573e-07 7.778538606738223e-08 1.144528469762286e-07 ] [ 2.391057119674114e-07 2.777606393450255e-07 -2.188611445891422e-08 ] [ -1.116151841948875e-07 -1.30847052092215e-07 -1.489077312733534e-07 ] [ 6.406475344819491e-09 1.045396925993209e-08 7.733144728972455e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 124.11875 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.988601610912875e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.8381678 -0.8787428 1.894294 ] [ 0.2747337 1.4199343 1.5105152 ] [ 2.9295611 3.389691 0.4001392 ] [ 1.1124441 1.9662436 -0.7622369 ] [ 1.979726 2.7601897 2.7197895 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.381678e-11 -8.787428e-11 1.894294e-10 ] [ 2.747337e-11 1.4199343e-10 1.5105152e-10 ] [ 2.9295611e-10 3.389691e-10 4.001392e-11 ] [ 1.1124441e-10 1.9662436e-10 -7.622369000000001e-11 ] [ 1.979726e-10 2.7601897e-10 2.7197895e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.1e-06 5.2e-06 4.5e-06 ] [ 4e-07 7.4e-06 5.8e-06 ] [ 3.2e-06 2.3e-06 -9e-07 ] [ -4e-07 4e-07 -5.9e-06 ] [ -8.3e-06 -1.53e-05 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.1711008334e-15 8.331318496799998e-15 7.209794853e-15 ] [ 6.408706536e-16 1.18561070916e-14 9.2926244772e-15 ] [ 5.1269652288e-15 3.685006258199999e-15 -1.4419589706e-15 ] [ -6.408706536e-16 6.408706536e-16 -9.452842140600001e-15 ] [ -1.32980660622e-14 -2.45133025002e-14 -5.607618218999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }