{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2298437 -4.3345762 -5.8935127 ] [ -1.1281819 -0.6521482 -0.6288155 ] [ -3.3645943 1.1954305 4.4080283 ] [ -1.2439648 -5.098028 -6.4197392 ] [ 4.2540559 5.1575388 4.5829749 ] [ -0.4656885 -0.6675194 0.0459355 ] [ 5.1782173 4.3993026 3.9051287 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.174780107612105e-09 -6.94475670593251e-09 -9.44244834012225e-09 ] [ -1.807546679081724e-09 -1.044856607945158e-09 -1.007473501197027e-09 ] [ -5.390674370349586e-09 1.915290814670937e-09 7.062439944270741e-09 ] [ -1.993051336078483e-09 -8.167941341077751e-09 -1.028555614261385e-08 ] [ 6.81574896270984e-09 8.2632881543084e-09 7.342735298988486e-09 ] [ -7.46115233422509e-10 -1.069483985421699e-09 7.359678477110698e-11 ] [ 8.296418763834568e-09 7.048459831615448e-09 6.256705955902795e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.506228 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.644589281707655e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5516014 2.7392183 1.6225391 ] [ 2.0677297 0.7255004 2.9297487 ] [ 2.5341363 2.7681233 4.2963849 ] [ 4.3337592 0.8336226 1.9715925 ] [ 5.1509408 2.138612 3.9332766 ] [ 4.0174561 4.4279274 0.7562507 ] [ 4.1451704 4.2060077 3.1253664 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5516014e-10 2.7392183e-10 1.6225391e-10 ] [ 2.0677297e-10 7.255004000000001e-11 2.929748700000001e-10 ] [ 2.5341363e-10 2.7681233e-10 4.2963849e-10 ] [ 4.3337592e-10 8.336226e-11 1.9715925e-10 ] [ 5.1509408e-10 2.138612e-10 3.9332766e-10 ] [ 4.017456100000001e-10 4.4279274e-10 7.562507000000001e-11 ] [ 4.1451704e-10 4.2060077e-10 3.1253664e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001453 -1.15e-05 0.0001612 ] [ 0.0001212 4.14e-05 8.19e-05 ] [ -5.15e-05 1.5e-06 6.73e-05 ] [ 2.83e-05 -2.14e-05 -7.78e-05 ] [ -0.0002564 -3.41e-05 -0.0001378 ] [ 5.8e-05 4e-05 -7.2e-05 ] [ -4.49e-05 -1.59e-05 -2.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.327962649202e-13 -1.8425031291e-14 2.582708734007999e-13 ] [ 1.941838080408e-13 6.633011264759999e-14 1.312182663246e-13 ] [ -8.251209665099998e-14 2.403264951e-15 1.078264874682e-13 ] [ 4.53415987422e-14 -3.42865799676e-14 -1.246493421252e-13 ] [ -4.107980889576e-13 -5.46342232194e-14 -2.207799401651999e-13 ] [ 9.292624477199999e-14 6.408706535999999e-14 -1.15356717648e-13 ] [ -7.193773086659999e-14 -2.54746084806e-14 -3.636940959179999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.958421 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.357909241173491e-18 } }