{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2975044 -5.8416324 0.44967 ] [ -2.2502608 3.2897678 -5.4642926 ] [ 1.2726738 4.2231023 4.28777 ] [ 9.7442301 -42.9504123 -76.7932607 ] [ 2.7744481 -5.5617021 110.695825 ] [ -11.2435868 46.8408768 -33.1757117 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.766545942651315e-10 -9.359326858587795e-09 7.20450761075136e-10 ] [ -3.605315244462704e-09 5.27078905702065e-09 -8.754761852930447e-09 ] [ 2.039048208264695e-09 6.766155772306708e-09 6.869764849367616e-09 ] [ 1.561197765391565e-08 -6.881414644078076e-08 -1.230363669285395e-07 ] [ 4.44515588144298e-09 -8.910829076474263e-09 1.773542628351682e-07 ] [ -1.801421190489548e-08 7.504735770673312e-08 -5.315334966414103e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 19.591838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.138958480210103e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1864937 0.419659 1.5657503 ] [ 0.2553959 2.894307 0.6494019 ] [ 0.6535242 2.4511709 3.1853772 ] [ 2.6854105 0.410701 1.1718513 ] [ 3.0492211 1.6908149 3.2913724 ] [ 2.4680999 2.3376649 -0.4102367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.864937e-11 4.19659e-11 1.5657503e-10 ] [ 2.553959e-11 2.894307e-10 6.494019e-11 ] [ 6.535242e-11 2.4511709e-10 3.1853772e-10 ] [ 2.6854105e-10 4.10701e-11 1.1718513e-10 ] [ 3.0492211e-10 1.6908149e-10 3.2913724e-10 ] [ 2.4680999e-10 2.3376649e-10 -4.102367e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 -1.89e-05 -3.1e-06 ] [ 1.3e-06 1.94e-05 8.6e-06 ] [ 2.5e-06 -5e-07 -2.33e-05 ] [ 5.1e-06 3.2e-06 1.51e-05 ] [ 8.7e-06 -2.6e-06 3.3e-06 ] [ -1e-05 -6e-07 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233675998016e-14 -3.028113813312e-14 -4.96674752448e-15 ] [ 2.08282960704e-15 3.108222644352e-14 1.377871893888e-14 ] [ 4.005441552e-15 -8.010883104e-16 -3.733071526464e-14 ] [ 8.17110076608e-15 5.126965186560001e-15 2.419286697408e-14 ] [ 1.393893660096e-14 -4.16565921408e-15 5.28718284864e-15 ] [ -1.6021766208e-14 -9.6130597248e-16 -9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -19.625291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.144318241659665e-18 } }