{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.9743985 -58.0939654 -12.9150985 ] [ -22.5673475 10.4912425 31.403722 ] [ -16.7347732 12.3429131 -21.8982644 ] [ -7.5178483 13.6361372 -0.9937536 ] [ 21.5187234 10.7265451 -30.5513961 ] [ 39.275644 10.8971274 34.9547906 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.238945475090465e-08 -9.307679394028446e-08 -2.069226904250845e-08 ] [ -3.615687685585831e-08 1.680882359512774e-08 5.031430960903174e-08 ] [ -2.68120625963294e-08 1.977552696431251e-08 -3.508488754683402e-08 ] [ -1.204492088421662e-08 2.184750039985818e-08 -1.592168797873382e-09 ] [ 3.447679582498903e-08 1.718581992276719e-08 -4.894873296749873e-08 ] [ 6.292651910210228e-08 1.745912289800117e-08 5.600374874568284e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.3277616 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.334254504904245e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.185126 0.1248944 1.2982907 ] [ 0.8142926 1.4847812 3.1843334 ] [ 0.674986 1.8132161 -0.2616097 ] [ -0.2826971 2.7976234 1.6123697 ] [ 2.9551792 1.3023563 0.1517452 ] [ 3.0501498 1.0784476 2.5009981 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.185126e-10 1.248944e-11 1.2982907e-10 ] [ 8.142926000000001e-11 1.4847812e-10 3.1843334e-10 ] [ 6.74986e-11 1.8132161e-10 -2.616097e-11 ] [ -2.826971e-11 2.7976234e-10 1.6123697e-10 ] [ 2.9551792e-10 1.3023563e-10 1.517452e-11 ] [ 3.0501498e-10 1.0784476e-10 2.5009981e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 4.2e-06 6.9e-06 ] [ -4.8e-06 -2.7e-06 -5.7e-06 ] [ 2.2e-06 8e-07 8.2e-06 ] [ 2.3e-06 -2.5e-06 -3.8e-06 ] [ -1.5e-06 1.1e-06 -5e-07 ] [ 2.8e-06 -1.1e-06 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.4419589706e-15 6.729141862799999e-15 1.10550187746e-14 ] [ -7.690447843199998e-15 -4.3258769118e-15 -9.1324068138e-15 ] [ 3.5247885948e-15 1.2817413072e-15 1.31378483988e-14 ] [ 3.685006258199999e-15 -4.005441585e-15 -6.088271209199999e-15 ] [ -2.403264951e-15 1.7623942974e-15 -8.010883169999999e-16 ] [ 4.486094575199999e-15 -1.7623942974e-15 -8.010883169999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.017216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.726458585093095e-18 } }