{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] "source-value" [ 5.40103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] "source-value" [ -0.134454 5.44836 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] "source-value" [ -0.122267 -0.177468 5.33534 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.16118649715049e-10 1.844467702892425e-09 2.851338617162004e-09 ] [ -2.315966492791822e-09 -1.871689484768127e-09 9.827397310954004e-10 ] [ 6.700350693484224e-10 -2.849350636410916e-09 3.768263335939872e-10 ] [ 2.517331415064869e-09 -1.139105440143673e-09 -8.01679032920089e-10 ] [ -2.640410783292388e-09 1.09436209452524e-09 2.755573957054195e-10 ] [ -4.147996819012301e-10 3.094387208360744e-09 -4.745294671953024e-10 ] [ 1.718110761951736e-09 1.126262071916016e-09 -1.411468255884879e-09 ] [ -3.504187778769754e-10 -1.299333516371708e-09 -1.798785481774203e-09 ] ] "source-value" [ [ 0.5093812000000001 1.1512262000000002 1.7796656000000004 ] [ -1.4455126000000003 -1.1682167000000003 0.6133779000000001 ] [ 0.4182030000000001 -1.7784248000000005 0.23519650000000006 ] [ 1.5711947000000004 -0.7109737000000002 -0.5003687000000001 ] [ -1.6480148000000003 0.6830471000000001 0.17198940000000001 ] [ -0.25889760000000006 1.9313646000000004 -0.29617800000000005 ] [ 1.0723604000000002 0.7029575000000001 -0.8809692000000002 ] [ -0.21871420000000005 -0.8109802000000003 -1.1227136000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.2652e-11 -1.01854e-11 -4.28595e-12 ] [ 1.30252e-10 1.39257e-10 1.42794e-10 ] [ -1.34723e-11 2.79807e-10 2.80389e-10 ] [ 1.19895e-10 4.084240000000001e-10 4.16214e-10 ] [ 2.70678e-10 2.24968e-12 2.81634e-10 ] [ 3.95472e-10 1.30925e-10 4.227070000000001e-10 ] [ 2.581e-10 2.82078e-10 2.50931e-11 ] [ 3.97059e-10 4.21723e-10 1.58759e-10 ] ] "source-value" [ [ -0.12652 -0.101854 -0.0428595 ] [ 1.30252 1.39257 1.42794 ] [ -0.134723 2.79807 2.80389 ] [ 1.19895 4.08424 4.16214 ] [ 2.70678 0.0224968 2.81634 ] [ 3.95472 1.30925 4.22707 ] [ 2.581 2.82078 0.250931 ] [ 3.97059 4.21723 1.58759 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.822549846044997e-18 "source-value" -36.341498 } }