{ "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" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.7189972 -5.2425387 0.0752791 ] [ -3.1617572 4.9278385 0.3500109 ] [ 9.1316337 -11.4894875 0.7383783 ] [ -8.566792 -1.8681899 -5.5762513 ] [ -2.0451166 -0.0918325 3.0469583 ] [ 0.9230348 13.7642101 1.3656246 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.958490366660662e-09 -8.399472938779226e-09 1.206104140548653e-10 ] [ -5.065693466486069e-09 7.89526763577814e-09 5.607792810051668e-10 ] [ 1.46304900238494e-08 -1.840818825747384e-08 1.183012449566049e-09 ] [ -1.372551385765647e-08 -2.99317018099469e-09 -8.934139464565606e-09 ] [ -3.276638003329986e-09 -1.47131884529616e-10 4.881765352812512e-09 ] [ 1.478864776744804e-09 2.205269562599923e-08 2.187971806909352e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.055918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.93157099618819e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0772091 0.9117603 3.840898 ] [ 1.7005164 2.9188502 4.1241216 ] [ 5.1969826 1.8422405 2.9941717 ] [ 3.0011246 2.7326387 2.0633745 ] [ 4.0114615 3.0236022 4.912478 ] [ 4.7207388 4.2445821 2.9177111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0772091e-10 9.117603e-11 3.840898000000001e-10 ] [ 1.7005164e-10 2.9188502e-10 4.1241216e-10 ] [ 5.196982600000001e-10 1.8422405e-10 2.9941717e-10 ] [ 3.0011246e-10 2.7326387e-10 2.0633745e-10 ] [ 4.0114615e-10 3.0236022e-10 4.912478000000001e-10 ] [ 4.7207388e-10 4.2445821e-10 2.9177111e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.8e-06 2.59e-05 3.3e-06 ] [ 1.44e-05 -2.23e-05 8.2e-06 ] [ -1.52e-05 -3e-07 9e-07 ] [ -3.2e-06 3.2e-06 -1.99e-05 ] [ -3.3e-06 1.72e-05 -1.84e-05 ] [ 1.5e-06 -2.36e-05 2.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.292624400640001e-15 4.149637447872e-14 5.28718284864e-15 ] [ 2.307134333952e-14 -3.572853864384e-14 1.313784829056e-14 ] [ -2.435308463616e-14 -4.8065298624e-16 1.44195895872e-15 ] [ -5.126965186560001e-15 5.126965186560001e-15 -3.188331475392e-14 ] [ -5.28718284864e-15 2.755743787776e-14 -2.948004982272e-14 ] [ 2.4032649312e-15 -3.781136825088e-14 4.149637447872e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.587451 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.817820281166558e-18 } }