{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.9530216 -0.2937587 7.5702496 ] [ -24.1842016 4.4816239 13.2433929 ] [ 9.1970533 -29.6967574 7.6327472 ] [ 122.7660998 12.700615 25.6662135 ] [ -99.82593 12.8082772 -54.1126032 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.274214537721729e-08 -4.706533251742158e-10 1.212887702266785e-08 ] [ -3.874736271546541e-08 7.180353094955952e-09 2.12182546592615e-08 ] [ 1.473530389891259e-08 -4.757945081184659e-08 1.222900921706892e-08 ] [ 1.96692976546872e-07 2.034862859042991e-08 4.112180755295535e-08 ] [ -1.599387725133196e-07 2.052112245163494e-08 -8.669794845195362e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 33.614038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.385562625798809e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0425276 0.348256 3.0829296 ] [ -0.1439419 2.005717 1.9682533 ] [ 3.1246725 0.1520422 2.0712167 ] [ 3.2250398 1.6882364 0.3312672 ] [ 1.2049249 2.8338703 0.2676326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0425276e-10 3.48256e-11 3.0829296e-10 ] [ -1.439419e-11 2.005717e-10 1.9682533e-10 ] [ 3.1246725e-10 1.520422e-11 2.0712167e-10 ] [ 3.2250398e-10 1.6882364e-10 3.312672e-11 ] [ 1.2049249e-10 2.8338703e-10 2.676326e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -1e-07 1e-07 ] [ 4e-07 -1e-07 -2e-07 ] [ 1e-07 -2e-07 2e-07 ] [ -5e-07 -1e-07 3e-07 ] [ -2e-07 5e-07 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-16 -1.602176634e-16 1.602176634e-16 ] [ 6.408706536e-16 -1.602176634e-16 -3.204353268e-16 ] [ 1.602176634e-16 -3.204353268e-16 3.204353268e-16 ] [ -8.010883169999999e-16 -1.602176634e-16 4.806529901999999e-16 ] [ -3.204353268e-16 8.010883169999999e-16 -6.408706536e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.43342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992053500470828e-18 } }