{ "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" [ [ 0.0068904 0.1581444 0.9739303 ] [ 1.486449 0.0094288 0.6635661 ] [ 1.283407 0.7092398 2.988588 ] [ 0.3149749 1.776241 2.685574 ] [ 2.9726 1.648627 0.444947 ] [ 2.196005 2.727691 2.654363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.8904e-13 1.581444e-11 9.739303e-11 ] [ 1.486449e-10 9.4288e-13 6.635661000000001e-11 ] [ 1.283407e-10 7.092398e-11 2.988588e-10 ] [ 3.149749e-11 1.776241e-10 2.685574e-10 ] [ 2.9726e-10 1.648627e-10 4.44947e-11 ] [ 2.196005e-10 2.727691e-10 2.654363e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -66.232517 10.6959242 19.9769519 ] [ 70.254905 -7.2314288 -12.8949029 ] [ 53.5079162 -61.966926 10.8590903 ] [ -57.7245111 58.9529056 -17.8832622 ] [ -1.2684089 0.1656502 1.5113902 ] [ 1.4626158 -0.6161252 -1.5692672 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.061161902741386e-07 1.713675969108894e-08 3.200660528902614e-08 ] [ 1.12560766287525e-07 -1.15860261583398e-08 -2.065991195386612e-08 ] [ 8.572913236336558e-08 -9.928196010004366e-08 1.739818060181606e-08 ] [ -9.24848621315301e-08 9.44529670805494e-08 -2.865214460047638e-08 ] [ -2.032215085194645e-09 2.654008776708442e-10 2.421514043346236e-09 ] [ 2.343368839972689e-09 -9.871413909257242e-10 -2.514243219628278e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 14.077461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.255457889442379e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3081806 0.2043284 1.3719337 ] [ 1.7118388 -0.1631273 0.3168151 ] [ 1.7079891 0.5317424 2.5926438 ] [ -0.0914145 2.0856211 2.6919899 ] [ 3.1775681 1.4902623 0.9852069 ] [ 2.0625255 2.8805451 2.452379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.081806e-11 2.043284e-11 1.3719337e-10 ] [ 1.7118388e-10 -1.631273e-11 3.168151e-11 ] [ 1.7079891e-10 5.317423999999999e-11 2.5926438e-10 ] [ -9.14145e-12 2.0856211e-10 2.6919899e-10 ] [ 3.1775681e-10 1.4902623e-10 9.852069e-11 ] [ 2.0625255e-10 2.8805451e-10 2.452379e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.54e-05 -4e-06 -1.2e-05 ] [ 1.84e-05 9.9e-06 5.3e-05 ] [ -1.45e-05 -3.7e-06 -3.68e-05 ] [ 1.06e-05 2.11e-05 -5.8e-06 ] [ -6.64e-05 4.7e-06 -1.36e-05 ] [ 1.64e-05 -2.8e-05 1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.671705237632e-14 -6.4087064832e-15 -1.92261194496e-14 ] [ 2.948004982272e-14 1.586154854592e-14 8.49153609024e-14 ] [ -2.32315610016e-14 -5.928053496960001e-15 -5.896009964544001e-14 ] [ 1.698307218048e-14 3.380592669888e-14 -9.292624400640001e-15 ] [ -1.0638452762112e-13 7.53023011776e-15 -2.178960204288e-14 ] [ 2.627569658112e-14 -4.48609453824e-14 2.435308463616e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.896573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.828653057784052e-18 } }