{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.441410000000001e-10 0.0 0.0 ] "source-value" [ 5.44141 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.87259e-12 5.36248e-10 0.0 ] "source-value" [ 0.0387259 5.36248 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.84794e-11 -3.14768e-13 5.51994e-10 ] "source-value" [ -0.184794 -0.00314768 5.51994 ] } "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" [ [ 7.008853006172506e-09 5.566682560138559e-10 -1.207403505788122e-09 ] [ -6.27999242001479e-10 -1.922986213418619e-09 7.367255109715604e-10 ] [ 8.248285624787041e-10 6.670138448945798e-10 2.816696033831743e-09 ] [ -5.005806187230172e-09 -4.707187702115607e-09 4.919462646087992e-09 ] [ 2.998759534354013e-09 5.582486109890807e-09 -2.270301254745781e-09 ] [ -2.778462492041282e-09 1.603753483030191e-09 -3.097420128703918e-09 ] [ -1.170340834672142e-09 -1.10140013598509e-09 -4.676313117762142e-09 ] [ -1.249832347060147e-09 -6.783476423101191e-10 2.778553816108668e-09 ] ] "source-value" [ [ 4.374582 0.347445 -0.7536019999999999 ] [ -0.3919663 -1.2002336 0.45982789999999996 ] [ 0.5148175 0.4163173 1.7580433999999998 ] [ -3.1243785 -2.9379955 3.0704870999999994 ] [ 1.8716785 3.4843138 -1.4170105999999998 ] [ -1.7341799 1.0009842 -1.9332575999999997 ] [ -0.7304693 -0.6874399 -2.9187250999999996 ] [ -0.780084 -0.4233913 1.7342368999999997 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.39299e-11 -1.33288e-12 1.35909e-12 ] [ 1.42253e-10 1.35934e-10 1.29237e-10 ] [ 1.99653e-12 2.64656e-10 2.62294e-10 ] [ 1.43068e-10 4.14401e-10 3.95964e-10 ] [ 2.73386e-10 -8.042870000000001e-12 2.7169e-10 ] [ 4.04879e-10 1.39288e-10 4.20461e-10 ] [ 2.827650000000001e-10 2.77065e-10 1.03593e-11 ] [ 4.1636e-10 4.04392e-10 1.34337e-10 ] ] "source-value" [ [ -0.139299 -0.0133288 0.0135909 ] [ 1.42253 1.35934 1.29237 ] [ 0.0199653 2.64656 2.62294 ] [ 1.43068 4.14401 3.95964 ] [ 2.73386 -0.0804287 2.7169 ] [ 4.04879 1.39288 4.20461 ] [ 2.82765 2.77065 0.103593 ] [ 4.1636 4.04392 1.34337 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.669953577932479e-18 "source-value" -35.389067 } }