{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2822382 -3.1122717 -0.1300408 ] [ 2.2674533 -11.0568214 -0.4730645 ] [ -1.1498105 -1.0799574 0.2189067 ] [ 0.6096209 1.6031361 -1.6640694 ] [ 4.2597003 3.1676177 1.0198846 ] [ -3.6354665 2.8826489 -7.2539488 ] [ -0.0692593 7.5956478 8.2823322 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.656548717262219e-09 -4.986408996399457e-09 -2.083483312266672e-10 ] [ 3.632860695946192e-09 -1.771498089339117e-08 -7.579328882748928e-10 ] [ -1.842199516627857e-09 -1.730282511995392e-09 3.507271997660478e-10 ] [ 9.767203615780506e-10 2.568507200541887e-09 -2.666133110034399e-09 ] [ 6.82479228850279e-09 5.075083064384821e-09 1.634035275496436e-09 ] [ -5.824659479989761e-09 4.618512711605802e-09 -1.162210727159234e-08 ] [ -1.109656321471962e-10 1.21695694252535e-08 1.326975912586581e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.545044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.811025953930189e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9829115 2.7364618 2.8157854 ] [ 4.9069105 1.3327173 1.7557383 ] [ 5.1111499 2.3376624 4.1193207 ] [ 3.264859 0.9138899 3.4799621 ] [ 5.7383493 3.6370104 2.1084074 ] [ 3.5317662 3.2878116 1.0432839 ] [ 3.7359895 4.2927491 3.4068702 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9829115e-10 2.7364618e-10 2.8157854e-10 ] [ 4.9069105e-10 1.3327173e-10 1.7557383e-10 ] [ 5.1111499e-10 2.3376624e-10 4.119320700000001e-10 ] [ 3.264859e-10 9.138899e-11 3.4799621e-10 ] [ 5.7383493e-10 3.6370104e-10 2.1084074e-10 ] [ 3.5317662e-10 3.2878116e-10 1.0432839e-10 ] [ 3.7359895e-10 4.2927491e-10 3.406870200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.4e-06 6.6e-06 1.34e-05 ] [ 2.05e-05 -3.77e-05 -5e-06 ] [ -5.8e-06 9.6e-06 -1.56e-05 ] [ 4e-07 -6.5e-06 -1.55e-05 ] [ 9.2e-06 7.2e-06 2.19e-05 ] [ -1.93e-05 -4.1e-06 -2.3e-06 ] [ 3.5e-06 2.47e-05 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.34582837256e-14 1.05743657844e-14 2.14691668956e-14 ] [ 3.2844620997e-14 -6.040205910179999e-14 -8.010883169999999e-15 ] [ -9.2926244772e-15 1.53808956864e-14 -2.49939554904e-14 ] [ 6.408706536e-16 -1.0414148121e-14 -2.4833737827e-14 ] [ 1.47400250328e-14 1.15356717648e-14 3.50876682846e-14 ] [ -3.09220090362e-14 -6.568924199399999e-15 -3.685006258199999e-15 ] [ 5.607618218999999e-15 3.95737628598e-14 5.1269652288e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.152427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.549210092579071e-18 } }