{ "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" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -116.1489082 -100.4080991 -81.1270061 ] [ 76.9985157 48.3942437 69.9730654 ] [ 20.2049788 67.8621111 -33.748104 ] [ -36.1570325 35.0792884 33.3084264 ] [ 38.9194244 -45.3767036 -19.2185043 ] [ 16.1830218 -5.5508404 30.8121226 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.860910652494854e-07 -1.608715089169895e-07 -1.29979792488919e-07 ] [ 1.233652216908418e-07 7.753612583743768e-08 1.121092094695894e-07 ] [ 3.237194465711964e-08 1.087270878425522e-07 -5.407042322512696e-08 ] [ -5.792995214900578e-08 5.620321574878065e-08 5.336598205371751e-08 ] [ 6.235579186867307e-08 -7.270149363689119e-08 -3.079143827620427e-08 ] [ 2.592805918185673e-08 -8.893426714672122e-09 4.936646246694331e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 96.354808 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.543774206792728e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3307622 0.1205498 0.1957199 ] [ 0.9682659 2.040034 1.3955187 ] [ 2.0058014 3.5666508 -0.0616417 ] [ -0.9362881 3.0369819 2.3489949 ] [ 2.2515009 -1.0631266 -0.4676232 ] [ 2.4727903 1.4359518 3.0990004 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.307622e-11 1.205498e-11 1.957199e-11 ] [ 9.682659e-11 2.040034e-10 1.3955187e-10 ] [ 2.0058014e-10 3.5666508e-10 -6.16417e-12 ] [ -9.362881e-11 3.0369819e-10 2.3489949e-10 ] [ 2.2515009e-10 -1.0631266e-10 -4.676232e-11 ] [ 2.4727903e-10 1.4359518e-10 3.0990004e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.2e-06 -6.7e-06 -5.3e-06 ] [ 2.29e-05 1.1e-06 4.9e-06 ] [ -3.5e-06 -2.8e-06 3.2e-06 ] [ -7e-06 6.3e-06 6.8e-06 ] [ 3.6e-06 -2.8e-06 -1.6e-06 ] [ -1.08e-05 4.9e-06 -8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.33131842816e-15 -1.073458335936e-14 -8.491536090240001e-15 ] [ 3.668984461632e-14 1.76239428288e-15 7.850665441919999e-15 ] [ -5.6076181728e-15 -4.48609453824e-15 5.126965186560001e-15 ] [ -1.12152363456e-14 1.009371271104e-14 1.089480102144e-14 ] [ 5.76783583488e-15 -4.48609453824e-15 -2.56348259328e-15 ] [ -1.730350750464e-14 7.850665441919999e-15 -1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.574999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.854519278358338e-18 } }