{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 38.4377327 -197.4618607 76.0404233 ] [ -120.3750637 103.3935367 -97.5373557 ] [ -124.6290316 288.2913942 80.6707243 ] [ 160.5946353 -265.1986251 30.9075773 ] [ 45.9717272 70.9755549 -90.0813692 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.158403668849966e-08 -3.163687767132063e-07 1.218301884469956e-07 ] [ -1.928621127874507e-07 1.656547072425668e-07 -1.562720709571936e-07 ] [ -1.996777207024644e-07 4.618937317650767e-07 1.292487484564625e-07 ] [ 2.573009701035624e-07 -4.248950370035241e-07 4.951939775562879e-08 ] [ 7.365482653763543e-08 1.137153747090869e-07 -1.443262637018932e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 205.07403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.285648163992378e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.3066417 -0.4944246 1.3577831 ] [ -0.3445502 2.3908574 1.029456 ] [ 0.6724503 2.9715617 3.5869383 ] [ 2.0739798 0.5224152 3.8656559 ] [ 2.0796053 1.6358942 -0.8024852 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3066417e-10 -4.944246e-11 1.3577831e-10 ] [ -3.445502e-11 2.3908574e-10 1.029456e-10 ] [ 6.724503e-11 2.9715617e-10 3.5869383e-10 ] [ 2.0739798e-10 5.224152e-11 3.8656559e-10 ] [ 2.0796053e-10 1.6358942e-10 -8.024852e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.49e-05 -1.08e-05 -4e-07 ] [ 2.83e-05 -1.1e-06 4.57e-05 ] [ -3.42e-05 7.5e-06 -5.46e-05 ] [ 2.53e-05 -9.9e-06 1e-06 ] [ 5.4e-06 1.43e-05 8.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.989419785791999e-14 -1.730350750464e-14 -6.408706483200001e-16 ] [ 4.534159836864e-14 -1.76239428288e-15 7.321947157056e-14 ] [ -5.479444043136e-14 1.2016324656e-14 -8.747884349568e-14 ] [ 4.053506850624e-14 -1.586154854592e-14 1.6021766208e-15 ] [ 8.65175375232e-15 2.291112567744e-14 1.313784829056e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.673165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.870247205374083e-18 } }