{ "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" [ [ 0.9651302 0.0332184 0.096045 ] [ 1.129779 0.3019077 2.825054 ] [ 2.558191 0.7044327 0.6108776 ] [ 2.484706 2.424759 2.944886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.651302000000001e-11 3.32184e-12 9.604500000000001e-12 ] [ 1.129779e-10 3.019077e-11 2.825054e-10 ] [ 2.558191e-10 7.044327e-11 6.108776e-11 ] [ 2.484706e-10 2.424759e-10 2.944886e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.9011635 -8.3196003 -5.211327 ] [ 1.6889421 1.3151115 -2.8178801 ] [ 18.8710122 9.313271 9.6718087 ] [ -0.6587908 -2.3087822 -1.6426016 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.18851788864183e-08 -1.332946909506067e-08 -8.3494662827438e-09 ] [ 2.705983546504856e-09 2.107040899045219e-09 -4.514741616437566e-09 ] [ 3.023469455767157e-08 1.492150505937464e-08 1.549594577999004e-08 ] [ -1.055499217758129e-09 -3.69907686335919e-09 -2.631737880808673e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.9336533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.700230730792769e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7746319 -0.1558799 0.2568352 ] [ 1.0582629 0.3965962 2.5426745 ] [ 2.7557215 1.0131398 0.8220027 ] [ 2.5491898 2.2104618 2.8553502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.746319e-11 -1.558799e-11 2.568352e-11 ] [ 1.0582629e-10 3.965962e-11 2.5426745e-10 ] [ 2.7557215e-10 1.0131398e-10 8.220027e-11 ] [ 2.5491898e-10 2.2104618e-10 2.8553502e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 2e-07 0.0 ] [ 4e-07 -1e-07 -1e-07 ] [ 4e-07 -3e-07 1e-07 ] [ -4e-07 1e-07 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 3.2043532416e-16 0.0 ] [ 6.408706483200001e-16 -1.6021766208e-16 -1.6021766208e-16 ] [ 6.408706483200001e-16 -4.8065298624e-16 1.6021766208e-16 ] [ -6.408706483200001e-16 1.6021766208e-16 0.0 ] ] } "relaxed-potential-energy" { "source-value" -10.280975 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.647193778402928e-18 } }