{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5501292 -3.4893317 -10.2623587 ] [ -17.1781161 -21.1076376 20.5141292 ] [ -10.5288475 20.0366125 -1.4142113 ] [ -5.6701683 -43.4034314 -39.1955406 ] [ 29.3658987 20.5944764 33.3960761 ] [ 7.5613624 27.3693118 -3.0380948 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.687934005059408e-09 -5.590525671956319e-09 -1.644211118340348e-08 ] [ -2.752237600480808e-08 -3.381816348303902e-08 3.286725820031061e-08 ] [ -1.686907330846853e-08 3.210219210752904e-08 -2.265816281731175e-09 ] [ -9.084611086261281e-09 -6.953996305157661e-08 -6.279817878893721e-08 ] [ 4.704935634592111e-08 3.299598860569735e-08 5.350641235387765e-08 ] [ 1.211463805867618e-08 4.385047149334557e-08 -4.867564460334052e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 17.436284 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.793600657842911e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3461077 0.8191394 0.1884403 ] [ 0.593475 0.804214 3.839095 ] [ -0.0095345 2.3592733 1.9789342 ] [ 2.400854 -0.224583 0.8285057 ] [ 2.9015866 0.8805275 2.8857828 ] [ 2.3402125 3.1947039 2.1298407 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.461077e-11 8.191394e-11 1.884403e-11 ] [ 5.93475e-11 8.04214e-11 3.839095e-10 ] [ -9.5345e-13 2.3592733e-10 1.9789342e-10 ] [ 2.400854e-10 -2.24583e-11 8.285057000000001e-11 ] [ 2.9015866e-10 8.805275e-11 2.8857828e-10 ] [ 2.3402125e-10 3.1947039e-10 2.1298407e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.89e-05 -3.3e-06 -6e-07 ] [ 7e-07 1.79e-05 -1.52e-05 ] [ 1.67e-05 8.8e-06 4.68e-05 ] [ 9e-07 -6.6e-06 7.7e-06 ] [ -2.76e-05 -2.3e-06 -3.03e-05 ] [ -2.96e-05 -1.45e-05 -8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.232467054911999e-14 -5.28718284864e-15 -9.6130597248e-16 ] [ 1.12152363456e-15 2.867896151232001e-14 -2.435308463616e-14 ] [ 2.675634956736e-14 1.409915426304e-14 7.498186585344001e-14 ] [ 1.44195895872e-15 -1.057436569728e-14 1.233675998016e-14 ] [ -4.422007473408001e-14 -3.68500622784e-15 -4.854595161024e-14 ] [ -4.742442797568e-14 -2.32315610016e-14 -1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }