{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1425256 -3.5370593 -1.9117606 ] [ -1.2615226 1.0440859 -3.963169 ] [ -5.3775314 -1.4347518 6.2549546 ] [ -0.2519386 6.1547932 1.8558077 ] [ 9.0335182 -2.227068 -2.2358327 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.432704425785492e-09 -5.666993716843214e-09 -3.062978137886581e-09 ] [ -2.02118201633083e-09 1.672810019086927e-09 -6.349696716079316e-09 ] [ -8.615755086697892e-09 -2.298725790610717e-09 1.002154202428542e-08 ] [ -4.036501347970829e-10 9.861065770898819e-09 2.97333170964062e-09 ] [ 1.44732916636113e-08 -3.568156282531814e-09 -3.58219887996014e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3713223 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.003630391041685e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.377049 0.4885717 2.2843547 ] [ 2.0079422 2.6333142 1.2397546 ] [ 1.6600144 1.7011812 4.2446564 ] [ 3.0632916 3.4058102 3.2687533 ] [ 4.4925618 1.5070806 2.845243 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.377049e-10 4.885717e-11 2.2843547e-10 ] [ 2.0079422e-10 2.6333142e-10 1.2397546e-10 ] [ 1.6600144e-10 1.7011812e-10 4.244656400000001e-10 ] [ 3.0632916e-10 3.4058102e-10 3.2687533e-10 ] [ 4.4925618e-10 1.5070806e-10 2.845243e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 1.47e-05 2.8e-06 ] [ -3.8e-06 -3e-06 1.01e-05 ] [ 4.4e-06 -2.8e-06 -1e-05 ] [ 2.6e-06 -8.1e-06 -9.1e-06 ] [ -8.8e-06 -8e-07 6.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 2.355199632576e-14 4.48609453824e-15 ] [ -6.08827115904e-15 -4.8065298624e-15 1.618198387008e-14 ] [ 7.04957713152e-15 -4.48609453824e-15 -1.6021766208e-14 ] [ 4.16565921408e-15 -1.297763062848e-14 -1.457980724928e-14 ] [ -1.409915426304e-14 -1.28174129664e-15 9.93349504896e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }