{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.8982734 -17.4614732 -21.2782044 ] [ -21.5324781 -17.1153362 10.3175603 ] [ -14.8546713 12.9328014 -4.3675481 ] [ 14.3409567 27.0229328 6.8730042 ] [ 15.1479192 -5.3789247 8.4551881 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.105225236536653e-08 -2.797636412576576e-08 -3.409144162228369e-08 ] [ -3.449883299970801e-08 -2.742179151677192e-08 1.653055389635423e-08 ] [ -2.379980706652874e-08 2.072063204452951e-08 -6.997583456039459e-09 ] [ 2.297674554464512e-08 4.329551115760948e-08 1.101176664390021e-08 ] [ 2.426964199600744e-08 -8.617987399383654e-09 1.354670469828637e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.083796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.775819882091656e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4340969 0.5541856 2.0513557 ] [ 0.2887779 1.5182501 2.0336927 ] [ 0.5009476 3.7751269 2.6610762 ] [ 2.7773415 4.2057852 3.0668909 ] [ 3.9720741 2.2150971 2.6901955 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4340969e-10 5.541856e-11 2.0513557e-10 ] [ 2.887779e-11 1.5182501e-10 2.0336927e-10 ] [ 5.009476000000001e-11 3.7751269e-10 2.6610762e-10 ] [ 2.7773415e-10 4.2057852e-10 3.0668909e-10 ] [ 3.9720741e-10 2.2150971e-10 2.6901955e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.94e-05 -1.18e-05 1.97e-05 ] [ -1.1e-06 -1.38e-05 -2.76e-05 ] [ -1.53e-05 1.84e-05 1.61e-05 ] [ 1.3e-06 -5.6e-06 1.1e-06 ] [ 3.45e-05 1.28e-05 -9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.108222644352e-14 -1.890568412544e-14 3.156287942976e-14 ] [ -1.76239428288e-15 -2.211003736704e-14 -4.422007473408001e-14 ] [ -2.451330229824e-14 2.948004982272e-14 2.579504359488e-14 ] [ 2.08282960704e-15 -8.972189076479999e-15 1.76239428288e-15 ] [ 5.52750934176e-14 2.050786074624e-14 -1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }