{ "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" [ [ 2.870914 1.181011 0.8927792 ] [ 2.832979 2.546134 3.06224 ] [ 2.321808 0.2790243 3.178637 ] [ 4.863779 2.087833 1.955277 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.870914e-10 1.181011e-10 8.927792e-11 ] [ 2.832979e-10 2.546134e-10 3.06224e-10 ] [ 2.321808e-10 2.790243e-11 3.178637e-10 ] [ 4.863779e-10 2.087833e-10 1.955277e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7466887 -1.9437314 -3.9826958 ] [ -0.9689954 3.6318405 3.427036 ] [ -1.2333171 -2.3469207 1.0879071 ] [ 2.9490013 0.6588116 -0.5322472 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.196327178155545e-09 -3.114201006194853e-09 -6.380982098518353e-09 ] [ -1.552501775542744e-09 5.818849939574583e-09 5.490716957839949e-09 ] [ -1.975991823652856e-09 -3.760181476411571e-09 1.743019321222328e-09 ] [ 4.724820937568806e-09 1.055532543031841e-09 -8.527540203262617e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.645835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.064780146269437e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2499296 0.5799309 0.8719886 ] [ 3.1948106 2.4670699 3.6724781 ] [ 1.9385067 0.6022084 2.8677868 ] [ 4.506233 2.444793 1.6766797 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2499296e-10 5.799309e-11 8.719886000000001e-11 ] [ 3.1948106e-10 2.4670699e-10 3.6724781e-10 ] [ 1.9385067e-10 6.022084e-11 2.8677868e-10 ] [ 4.506233e-10 2.444793000000001e-10 1.6766797e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 5e-07 1e-07 ] [ 0.0 5e-07 1e-07 ] [ -4e-07 -7e-07 1e-07 ] [ 3e-07 -3e-07 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 8.010883104e-16 1.6021766208e-16 ] [ 0.0 8.010883104e-16 1.6021766208e-16 ] [ -6.408706483200001e-16 -1.12152363456e-15 1.6021766208e-16 ] [ 4.8065298624e-16 -4.8065298624e-16 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.6918948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.392595063901309e-18 } }