{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.063467 2.922897 1.747229 ] [ 2.638051 1.139064 1.252514 ] [ 1.261727 4.223032 3.925248 ] [ 3.105304 3.068029 2.599226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.063467e-10 2.922897e-10 1.747229e-10 ] [ 2.638051e-10 1.139064e-10 1.252514e-10 ] [ 1.261727e-10 4.223032e-10 3.925248e-10 ] [ 3.105304e-10 3.068029e-10 2.599226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3767312 0.2669155 -1.3817092 ] [ 0.2754942 -1.2428069 -0.6900369 ] [ 0.0818013 -0.0881756 -0.1750803 ] [ 4.0194356 1.0640669 2.2468263 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.012296404165929e-09 4.276457738291425e-10 -2.213742176984271e-09 ] [ 4.413903664059994e-10 -1.991196159348923e-09 -1.105560988669307e-09 ] [ 1.31060130411047e-10 -1.412728848450125e-10 -2.805095634226502e-10 ] [ 6.439845747131221e-09 1.704823110147132e-09 3.599812568858567e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7879712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.087552875930372e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4530858 2.7146454 1.7240434 ] [ 2.556432 1.6170682 1.3269853 ] [ 1.4778372 4.0594278 3.4351386 ] [ 3.581194 2.9618806 3.0380497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.530858e-11 2.7146454e-10 1.7240434e-10 ] [ 2.556432e-10 1.6170682e-10 1.3269853e-10 ] [ 1.4778372e-10 4.0594278e-10 3.4351386e-10 ] [ 3.581194e-10 2.9618806e-10 3.0380497e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.15e-05 -3.9e-06 1.24e-05 ] [ 1.7e-05 -2.7e-06 -2.06e-05 ] [ -6.1e-06 1.87e-05 -6.8e-06 ] [ 1.06e-05 -1.21e-05 1.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.44467973472e-14 -6.24848882112e-15 1.986699009792e-14 ] [ 2.72370025536e-14 -4.32587687616e-15 -3.300483838848e-14 ] [ -9.77327738688e-15 2.996070280896e-14 -1.089480102144e-14 ] [ 1.698307218048e-14 -1.938633711168e-14 2.4032649312e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7495813 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.401837460064887e-18 } }