{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43182e-10 0.0 0.0 ] "source-value" [ 5.43182 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] "source-value" [ -0.00436542 5.42411 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] "source-value" [ 0.250705 -0.013062 5.36378 ] } "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" [ [ -3.291244086275846e-10 2.158508419723488e-10 8.006445074760384e-11 ] [ -8.563938451733951e-11 -3.178575821947948e-10 3.512458214486324e-10 ] [ -3.988762893377472e-11 4.100503497441926e-10 -1.86729679712688e-10 ] [ 3.206245412189164e-10 -9.66617187977952e-11 -2.811127829203815e-10 ] [ 5.097645354399359e-11 1.960726124592211e-10 2.935703470177498e-10 ] [ -3.643545101246938e-10 -3.831821682487008e-10 5.458952204155968e-11 ] [ 1.507348593144711e-10 -1.3914903951648e-10 -5.890022630512071e-10 ] [ 2.966697576906873e-10 1.148767045820083e-10 2.773744242110688e-10 ] ] "source-value" [ [ -0.2054233 0.1347235 0.0499723 ] [ -0.0534519 -0.1983911 0.2192304 ] [ -0.0248959 0.2559333 -0.1165475 ] [ 0.2001181 -0.0603315 -0.1754568 ] [ 0.031817 0.1223789 0.1832322 ] [ -0.2274122 -0.2391635 0.0340721 ] [ 0.0940813 -0.08685 -0.3676263 ] [ 0.1851667 0.0717004 0.1731235 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.997944787204894e-18 "source-value" 31.194718 } }