{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.39854e-10 0.0 0.0 ] "source-value" [ 5.39854 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] "source-value" [ 0.0197648 5.43736 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] "source-value" [ -0.0299081 -0.213673 5.1785 ] } "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" [ [ -3.125148038174131e-09 1.313821855357707e-08 -6.956124572493668e-09 ] [ -4.623582120600711e-09 4.16172074351075e-09 -1.334550271737566e-08 ] [ -5.141919582703223e-09 2.864005745961373e-09 9.182633053010135e-09 ] [ -2.478383462719194e-09 1.089653457654371e-09 -9.089347120352365e-09 ] [ 1.653210400223486e-08 -1.608078174295652e-08 1.097425247941249e-08 ] [ 3.160806241264318e-09 -5.603626670184601e-09 -9.42839653249282e-09 ] [ 1.378568520282724e-09 -3.712978469244886e-09 1.074550571781932e-08 ] [ -5.702445559584641e-09 4.143788381682446e-09 7.916979852690236e-09 ] ] "source-value" [ [ -1.950564 8.2002311 -4.3416715 ] [ -2.885813 2.5975418 -8.3296077 ] [ -3.2093338 1.7875718 5.7313488 ] [ -1.5468853 0.6801082 -5.6731243 ] [ 10.3185278 -10.0368346 6.8495897 ] [ 1.9728201 -3.4975087 -5.8847423 ] [ 0.8604348 -2.3174589 6.7068172 ] [ -3.5591866 2.5863493 4.9413902 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.16883040226555e-18 "source-value" -26.019793 } }