{ "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" [ [ 0.1501776 0.7389508 1.254214 ] [ 0.5251994 1.126951 2.894489 ] [ 1.795844 1.050789 0.3566565 ] [ 2.560887 2.159455 0.963327 ] [ 1.607121 2.890729 1.590789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.501776e-11 7.389508e-11 1.254214e-10 ] [ 5.251994e-11 1.126951e-10 2.894489e-10 ] [ 1.795844e-10 1.050789e-10 3.566565e-11 ] [ 2.560887e-10 2.159455e-10 9.633270000000001e-11 ] [ 1.607121e-10 2.890729e-10 1.590789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -116.0460252 -100.0046582 -435.1933302 ] [ 114.9240009 119.4503266 436.8068005 ] [ -602.7395068 -800.9606157 -444.83521 ] [ 2537.9967913 -592.6686448 -773.0011551 ] [ -1934.1352603 1374.1835921 1216.2228949 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.859262285122077e-07 -1.60225125339135e-07 -6.972565791745346e-07 ] [ 1.841285474107781e-07 1.913805206254444e-07 6.998416435675498e-07 ] [ -9.656951462274827e-07 -1.283280372656113e-06 -7.127045735706583e-07 ] [ 4.066319122686277e-06 -9.495598465797796e-07 -1.238484378552615e-06 ] [ -3.098826295517583e-06 2.201684823949583e-06 1.948603887890476e-06 ] ] } "unrelaxed-potential-energy" { "source-value" 845.18853 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.35414130293432e-16 } "relaxed-configuration-positions" { "source-value" [ [ -0.0650572 -0.0163706 1.1964378 ] [ -0.0676122 1.7054787 3.0299255 ] [ 1.8638105 0.4850437 -0.3380097 ] [ 3.0519063 2.5182285 0.5457575 ] [ 1.8561816 3.2744945 2.6253645 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.50572e-12 -1.63706e-12 1.1964378e-10 ] [ -6.76122e-12 1.7054787e-10 3.0299255e-10 ] [ 1.8638105e-10 4.850437e-11 -3.380097000000001e-11 ] [ 3.0519063e-10 2.5182285e-10 5.457575e-11 ] [ 1.8561816e-10 3.2744945e-10 2.6253645e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001283 -1.1e-06 -2.97e-05 ] [ -2.7e-06 8.57e-05 -7.51e-05 ] [ -6.89e-05 1.09e-05 7.79e-05 ] [ -9.37e-05 6.5e-06 1.04e-05 ] [ 3.7e-05 -0.000102 1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.0555926044864e-13 -1.76239428288e-15 -4.758464563776e-14 ] [ -4.32587687616e-15 1.3730653640256e-13 -1.2032346422208e-13 ] [ -1.1038996917312e-13 1.746372516672e-14 1.2480955876032e-13 ] [ -1.5012394936896e-13 1.04141480352e-14 1.666263685632e-14 ] [ 5.92805349696e-14 -1.634220153216e-13 2.627569658112e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.851117 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.539628907096543e-18 } }