{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1890616 -0.4326061 -1.1948637 ] [ -0.3684366 -0.8122475 1.4864241 ] [ -1.484005 0.0146644 -0.8853807 ] [ -0.9710813 0.5060514 -2.233075 ] [ 0.8369576 0.2551836 1.8025867 ] [ 0.3616105 -0.4448089 0.2601912 ] [ 1.8140164 0.9137631 0.7641174 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.029100754110413e-10 -6.931113794354669e-10 -1.914382685182585e-09 ] [ -5.903005067670413e-10 -1.301363954803248e-09 2.381513941613681e-09 ] [ -2.377638116150304e-09 2.349495883805952e-11 -1.418536258047539e-09 ] [ -1.555843755756071e-09 8.107837220031091e-10 -3.57778055749296e-09 ] [ 1.340953899320878e-09 4.088491979315789e-10 2.888062267705023e-09 ] [ 5.793638889357983e-10 -7.126624203037651e-10 4.16872257577897e-10 ] [ 2.906374665827782e-09 1.464009875769733e-09 1.224251033826482e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.647281 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.788712076368805e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0967446 1.4869087 2.3802153 ] [ 2.5014188 2.0392631 4.6773508 ] [ 1.5958478 3.7153372 3.1074804 ] [ 4.2884586 2.090989 1.7608778 ] [ 4.8151616 2.127436 4.0572575 ] [ 3.620106 4.339305 1.9855416 ] [ 3.6557626 4.200703 4.3782835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0967446e-10 1.4869087e-10 2.3802153e-10 ] [ 2.5014188e-10 2.0392631e-10 4.6773508e-10 ] [ 1.5958478e-10 3.7153372e-10 3.1074804e-10 ] [ 4.2884586e-10 2.090989e-10 1.7608778e-10 ] [ 4.8151616e-10 2.127436e-10 4.0572575e-10 ] [ 3.620106e-10 4.339305000000001e-10 1.9855416e-10 ] [ 3.6557626e-10 4.200703e-10 4.3782835e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 1.3e-06 -1.53e-05 ] [ -6.3e-06 -7.1e-06 2.3e-05 ] [ -8.6e-06 -1.4e-06 -1.05e-05 ] [ 3.6e-06 -1.16e-05 2.2e-06 ] [ 9.5e-06 -3.3e-06 -4.7e-06 ] [ -5.5e-06 1.15e-05 -7.6e-06 ] [ 1.01e-05 1.06e-05 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.48609453824e-15 2.08282960704e-15 -2.451330229824e-14 ] [ -1.009371271104e-14 -1.137545400768e-14 3.68500622784e-14 ] [ -1.377871893888e-14 -2.24304726912e-15 -1.68228545184e-14 ] [ 5.76783583488e-15 -1.858524880128e-14 3.52478856576e-15 ] [ 1.52206778976e-14 -5.28718284864e-15 -7.53023011776e-15 ] [ -8.8119714144e-15 1.84250311392e-14 -1.217654231808e-14 ] [ 1.618198387008e-14 1.698307218048e-14 2.066807840832e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }