{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.223645 0.1945873 1.126976 ] [ 0.7288277 2.388611 0.0814776 ] [ 2.404153 0.5300895 0.5572584 ] [ 2.145602 0.6403931 2.690423 ] [ 2.26761 2.998114 1.480003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.23645e-11 1.945873e-11 1.126976e-10 ] [ 7.288277e-11 2.388611e-10 8.14776e-12 ] [ 2.404153e-10 5.300895e-11 5.572584000000001e-11 ] [ 2.145602e-10 6.403931000000001e-11 2.690423e-10 ] [ 2.26761e-10 2.998114e-10 1.480003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8018302 -3.4920073 -2.0396817 ] [ -6.7579958 0.3906811 -6.8253136 ] [ 5.7052493 -3.635775 -9.9229614 ] [ 3.6736212 -0.1080928 12.9184136 ] [ 6.1809555 6.845194 5.8695432 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.410208656669139e-08 -5.594812455722932e-09 -3.2679303336136e-09 ] [ -1.082750287422459e-08 6.259401246084269e-10 -1.093535787954828e-08 ] [ 9.140817044295567e-09 -5.825153703489121e-09 -1.589833676418084e-08 ] [ 5.885790000315241e-09 -1.731837570368102e-10 2.069758024774477e-08 ] [ 9.902982396305175e-09 1.096720979164044e-08 9.404044889815619e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3964359 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.024822005542581e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2072985 0.2626747 -0.0989656 ] [ 0.1270378 2.7510512 0.3793214 ] [ 2.1493128 -0.7223458 1.1993275 ] [ 3.2677926 1.1568029 2.4819209 ] [ 2.018396 3.3036118 1.9745337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072985e-11 2.626747e-11 -9.89656e-12 ] [ 1.270378e-11 2.7510512e-10 3.793214e-11 ] [ 2.1493128e-10 -7.223458000000001e-11 1.1993275e-10 ] [ 3.2677926e-10 1.1568029e-10 2.4819209e-10 ] [ 2.018396e-10 3.3036118e-10 1.9745337e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.77e-05 -6e-07 1.93e-05 ] [ 1.57e-05 1.7e-05 2.08e-05 ] [ -3.7e-06 -2.16e-05 3.7e-06 ] [ -2.89e-05 -9.8e-06 -3.3e-05 ] [ -2.07e-05 1.5e-05 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.040205860416e-14 -9.6130597248e-16 3.092200878144e-14 ] [ 2.515417294656e-14 2.72370025536e-14 3.332527371264e-14 ] [ -5.928053496960001e-15 -3.460701500928e-14 5.928053496960001e-15 ] [ -4.630290434112001e-14 -1.570133088384e-14 -5.28718284864e-14 ] [ -3.316505605055999e-14 2.4032649312e-14 -1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.716098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.197561154420164e-18 } }