{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6203277 -5.6217737 -8.6888915 ] [ -12.9960995 -38.8875968 12.3728917 ] [ 12.3342552 5.7042123 -8.3169433 ] [ 2.282172 38.8051583 4.6329432 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.596051158974636e-09 -9.007074389568314e-09 -1.392113882196784e-08 ] [ -2.082204678049057e-08 -6.230479843205689e-08 1.982355781343037e-08 ] [ 1.976165531642083e-08 9.139155587139795e-09 -1.33252121117792e-08 ] [ 3.656442623044378e-09 6.217271739470308e-08 7.422793280534338e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 7.8682255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.260628694328239e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8004188 -0.2395396 -0.1882221 ] [ 0.8906356 0.5693374 2.0181167 ] [ 3.2781213 3.1649634 0.4981379 ] [ 1.4938608 2.8422133 1.9956717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.004188e-11 -2.395396e-11 -1.882221e-11 ] [ 8.906356e-11 5.693374e-11 2.0181167e-10 ] [ 3.2781213e-10 3.1649634e-10 4.981379e-11 ] [ 1.4938608e-10 2.8422133e-10 1.9956717e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 -1.42e-05 3.3e-06 ] [ 8.6e-06 3.9e-06 -2.4e-05 ] [ -1.38e-05 -1.09e-05 9.7e-06 ] [ 9.1e-06 2.12e-05 1.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.24848882112e-15 -2.275090801536e-14 5.28718284864e-15 ] [ 1.377871893888e-14 6.24848882112e-15 -3.84522388992e-14 ] [ -2.211003736704e-14 -1.746372516672e-14 1.554111322176e-14 ] [ 1.457980724928e-14 3.396614436096001e-14 1.746372516672e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.945 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.1127116631456e-18 } }