{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -92.8897563 -68.9387732 -25.6912637 ] [ -12.7505236 -2.3768436 1.2475875 ] [ 105.9652321 -198.4360391 83.6579591 ] [ 370.5433399 -62.5079943 -679.3480067 ] [ -370.8682921 332.2596503 620.1337238 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.488257970818143e-07 -1.104520915976654e-07 -4.116194239807238e-08 ] [ -2.042859098318556e-08 -3.808123278592442e-09 1.998855541370475e-09 ] [ 1.697750188870067e-07 -3.179295851895304e-07 1.340348273181476e-07 ] [ 5.936758810720999e-07 -1.001488479056652e-07 -1.088435502689216e-06 ] [ -5.941965118941067e-07 5.323386481316709e-07 9.935637622277696e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 396.26132 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.348806278619969e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.9252196 0.0226312 0.3312099 ] [ -0.4618871 0.8269916 2.6815413 ] [ 4.1863873 -0.3735308 1.1541524 ] [ 2.4708286 2.4515771 0.4158993 ] [ 1.0804176 3.2507426 2.7660494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.252196e-11 2.26312e-12 3.312099e-11 ] [ -4.618871e-11 8.269916e-11 2.6815413e-10 ] [ 4.1863873e-10 -3.735308e-11 1.1541524e-10 ] [ 2.4708286e-10 2.4515771e-10 4.158993000000001e-11 ] [ 1.0804176e-10 3.250742600000001e-10 2.7660494e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 4.3e-06 4e-06 ] [ 3.6e-06 1.3e-06 -3.3e-06 ] [ -2.4e-06 2.2e-06 -1e-06 ] [ 1.3e-06 -6.3e-06 -2.5e-06 ] [ -3.6e-06 -1.6e-06 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7623942974e-15 6.8893595262e-15 6.408706535999999e-15 ] [ 5.767835882399999e-15 2.0828296242e-15 -5.2871828922e-15 ] [ -3.845223921599999e-15 3.5247885948e-15 -1.602176634e-15 ] [ 2.0828296242e-15 -1.00937127942e-14 -4.005441585e-15 ] [ -5.767835882399999e-15 -2.5634826144e-15 4.486094575199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.663744 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.868737810175769e-18 } }