{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.4260364 4.2505058 -2.0049403 ] [ -1.7590267 2.6340849 3.510703 ] [ -5.7992414 -3.8942726 0.6598674 ] [ -1.5629354 -3.5126278 2.5750793 ] [ -0.6151547 -0.5221807 0.4488721 ] [ 5.4063307 1.843989 1.1607934 ] [ -1.096009 -0.7994985 -6.3503749 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.693468735313478e-09 6.810061075441477e-09 -3.212268501224949e-09 ] [ -2.818271477322127e-09 4.220269278752226e-09 5.624766315513701e-09 ] [ -9.291409066005446e-09 -6.239312566146427e-09 1.057224129818331e-09 ] [ -2.504098578331443e-09 -5.627850185098825e-09 4.125731885157076e-09 ] [ -9.855864866352797e-10 -8.366257162657638e-10 7.191723902745113e-10 ] [ 8.661896723216862e-09 2.954396089153026e-09 1.859796062381416e-09 ] [ -1.756000010453706e-09 -1.280937815618049e-09 -1.017442228192009e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -20.112872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.222437356103285e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8897207 1.7760433 3.4369294 ] [ 2.9228417 6.0425749 2.3508381 ] [ 2.5991839 3.5784082 1.7073959 ] [ 4.5845041 2.0409291 1.5700196 ] [ 5.2165375 2.6420215 3.9505753 ] [ 4.9285945 4.4453481 2.2216115 ] [ 3.2319206 4.1801659 4.0906032 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8897207e-10 1.7760433e-10 3.4369294e-10 ] [ 2.9228417e-10 6.0425749e-10 2.3508381e-10 ] [ 2.5991839e-10 3.5784082e-10 1.7073959e-10 ] [ 4.5845041e-10 2.0409291e-10 1.5700196e-10 ] [ 5.2165375e-10 2.6420215e-10 3.9505753e-10 ] [ 4.9285945e-10 4.4453481e-10 2.2216115e-10 ] [ 3.2319206e-10 4.180165900000001e-10 4.090603200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.16e-05 -7.2e-06 -3e-07 ] [ -9.7e-06 3.2e-06 -9.7e-06 ] [ 1.7e-05 -1.22e-05 5.7e-06 ] [ 7.5e-06 4.7e-06 -2.03e-05 ] [ 2.6e-06 9.3e-06 -1.41e-05 ] [ 3.7e-06 -1.74e-05 1.19e-05 ] [ 5e-07 1.96e-05 2.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.46070152944e-14 -1.15356717648e-14 -4.806529901999999e-16 ] [ -1.55411133498e-14 5.1269652288e-15 -1.55411133498e-14 ] [ 2.723700277799999e-14 -1.95465549348e-14 9.1324068138e-15 ] [ 1.2016324755e-14 7.530230179799999e-15 -3.252418567019999e-14 ] [ 4.165659248399999e-15 1.49002426962e-14 -2.25906905394e-14 ] [ 5.9280535458e-15 -2.78778734316e-14 1.90659019446e-14 ] [ 8.010883169999999e-16 3.140266202639999e-14 4.293833379119999e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.837867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.139682677979968e-18 } }