{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.37815e-10 0.0 0.0 ] "source-value" [ 5.37815 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.12137e-12 5.761180000000001e-10 0.0 ] "source-value" [ 0.0312137 5.76118 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.2726e-11 5.469640000000001e-12 4.8758e-10 ] "source-value" [ 0.42726 0.0546964 4.8758 ] } "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" [ [ 3.555668229013352e-08 5.601061393153506e-08 -3.232170969091576e-08 ] [ 4.788062694015673e-09 -1.059296216131763e-09 2.696900166370892e-09 ] [ 2.248347668323585e-07 1.821065276162923e-07 -1.045824451802955e-07 ] [ -1.335470610053852e-08 -2.099362948243021e-09 -7.198609998610195e-09 ] [ -1.223245459713969e-08 -1.440156622173964e-08 -2.097359746814035e-08 ] [ -1.929258084405343e-07 -1.729514047369496e-07 1.044823586487531e-07 ] [ -3.729011610906893e-09 4.287323539916028e-09 2.170600287007159e-08 ] [ -4.293753106738831e-08 -5.189283528511468e-08 3.619110049254858e-08 ] ] "source-value" [ [ 22.1927357 34.9590758 -20.1736246 ] [ 2.9884737 -0.6611607 1.6832727 ] [ 140.3308249 113.6619554 -65.2752286 ] [ -8.335352 -1.3103193 -4.493019 ] [ -7.6348977 -8.9887507 -13.09069 ] [ -120.4148194 -107.9477771 65.2127595 ] [ -2.327466 2.6759369 13.5478215 ] [ -26.7994992 -32.3889605 22.5887084 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.37527e-12 -6.724230000000001e-12 1.75944e-11 ] [ 1.47307e-10 1.39309e-10 1.21037e-10 ] [ 1.98849e-11 2.42305e-10 2.74052e-10 ] [ 1.63292e-10 4.13291e-10 3.99992e-10 ] [ 2.96978e-10 -9.531040000000001e-12 2.878150000000001e-10 ] [ 4.41344e-10 1.46946e-10 3.21135e-10 ] [ 3.02165e-10 2.84712e-10 -5.91788e-11 ] [ 4.215550000000001e-10 4.28981e-10 8.02839e-11 ] ] "source-value" [ [ -0.0437527 -0.0672423 0.175944 ] [ 1.47307 1.39309 1.21037 ] [ 0.198849 2.42305 2.74052 ] [ 1.63292 4.13291 3.99992 ] [ 2.96978 -0.0953104 2.87815 ] [ 4.41344 1.46946 3.21135 ] [ 3.02165 2.84712 -0.591788 ] [ 4.21555 4.28981 0.802839 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.339452118668039e-18 "source-value" 27.08473 } }