{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.8196834e-10 3.178858e-11 4.360959e-11 ] [ 1.2829927e-10 1.031303e-10 5.8631576e-10 ] [ 1.8435414e-10 5.6020481e-10 -1.1761373e-10 ] [ -1.215963e-11 6.025421e-10 3.9433335e-10 ] [ 6.338162100000001e-10 6.716029e-11 3.710531e-10 ] [ 7.121732800000001e-10 4.2917979e-10 -3.55204e-11 ] [ 4.924437e-10 5.4447544e-10 6.052924300000001e-10 ] ] "source-value" [ [ 1.8196834 0.3178858 0.4360959 ] [ 1.2829927 1.031303 5.8631576 ] [ 1.8435414 5.6020481 -1.1761373 ] [ -0.1215963 6.025421 3.9433335 ] [ 6.3381621 0.6716029 3.710531 ] [ 7.1217328 4.2917979 -0.355204 ] [ 4.924437 5.4447544 6.0529243 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -3.2043532416e-16 1.6021766208e-16 -6.408706483200001e-16 ] [ -1.6021766208e-16 0.0 4.8065298624e-16 ] [ 0.0 -1.6021766208e-16 1.6021766208e-16 ] [ 6.408706483200001e-16 0.0 -1.6021766208e-16 ] [ 0.0 0.0 0.0 ] ] "source-value" [ [ 0.0 -0.0 -0.0 ] [ -0.0 0.0 0.0 ] [ -2e-07 1e-07 -4e-07 ] [ -1e-07 0.0 3e-07 ] [ -0.0 -1e-07 1e-07 ] [ 4e-07 0.0 -1e-07 ] [ 0.0 -0.0 0.0 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.838263533857537e-32 "source-value" 3.0198066e-13 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.287769598328123e-08 -2.247578977626634e-08 -1.564361038824607e-08 ] [ -1.314927741748448e-08 -1.659173365149013e-08 1.952318093947447e-08 ] [ -7.027455238045967e-09 1.502169332913247e-08 -2.243496215030915e-08 ] [ -1.78634357094242e-08 1.806198288367424e-08 5.778104825713355e-09 ] [ 2.230552919047418e-08 -1.322371934981671e-08 8.278651998716387e-09 ] [ 1.796052697177403e-08 6.172349062222708e-09 -1.561408227312473e-08 ] [ 1.065180818598766e-08 1.303521750254375e-08 2.011271704777573e-08 ] ] "source-value" [ [ -8.0376257 -14.0282847 -9.7639737 ] [ -8.2071335 -10.3557457 12.1854112 ] [ -4.3861926 9.3758036 -14.0028021 ] [ -11.1494797 11.2734031 3.6064094 ] [ 13.9220164 -8.2535965 5.1671282 ] [ 11.2100793 3.8524773 -9.7455437 ] [ 6.6483358 8.1359429 12.5533707 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.253231092391149e-17 "source-value" 78.220533 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] "source-value" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] } "instance-id" 1 }