{ "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" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8331489 -6.3051637 -16.1795496 ] [ -3.3328884 -4.0650304 14.8347012 ] [ 1.437688 9.1425866 6.8276004 ] [ 7.10448 -3.7672384 -0.0267997 ] [ -1.3969414 5.7990992 -8.7668227 ] [ -0.9791894 -0.8042532 3.3108703 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.539204930825237e-09 -1.010198587045682e-08 -2.5922496104194e-08 ] [ -5.339875874215518e-09 -6.512896669721273e-09 2.37678114391937e-08 ] [ 2.30343010160471e-09 1.464803850415936e-08 1.093902173704473e-08 ] [ 1.138263175894118e-08 -6.035781289459999e-09 -4.293785278445376e-11 ] [ -2.238146851707621e-09 9.291181159939982e-09 -1.404599836863873e-08 ] [ -1.56883436401518e-09 -1.288555674243587e-09 5.304598989161082e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.963875 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.19856537855736e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.598106 0.7283528 0.5937059 ] [ 1.041399 0.6373303 2.9161755 ] [ 0.3671804 2.6746073 1.9193853 ] [ 2.819764 0.466778 1.3647285 ] [ 2.1455458 2.5040548 0.3679381 ] [ 2.5888379 2.413033 2.6904079 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.981060000000001e-11 7.283528e-11 5.937059e-11 ] [ 1.041399e-10 6.373303e-11 2.9161755e-10 ] [ 3.671804e-11 2.6746073e-10 1.9193853e-10 ] [ 2.819764e-10 4.66778e-11 1.3647285e-10 ] [ 2.1455458e-10 2.5040548e-10 3.679381e-11 ] [ 2.5888379e-10 2.413033e-10 2.6904079e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -4.4e-06 -3.6e-06 ] [ -4.9e-06 -5.4e-06 9e-06 ] [ -3.7e-06 4.3e-06 -5e-07 ] [ 2.5e-06 -2.5e-06 -1.2e-06 ] [ 1.1e-06 7.1e-06 -6.7e-06 ] [ 5.6e-06 1e-06 2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-16 -7.04957713152e-15 -5.76783583488e-15 ] [ -7.850665441919999e-15 -8.65175375232e-15 1.44195895872e-14 ] [ -5.928053496960001e-15 6.889359469440001e-15 -8.010883104e-16 ] [ 4.005441552e-15 -4.005441552e-15 -1.92261194496e-15 ] [ 1.76239428288e-15 1.137545400768e-14 -1.073458335936e-14 ] [ 8.972189076479999e-15 1.6021766208e-15 4.646312200320001e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964547696158e-18 } }