{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42631e-10 0.0 0.0 ] "source-value" [ 5.42631 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] "source-value" [ -0.0419811 5.40206 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] "source-value" [ -0.291495 -0.184222 5.7849 ] } "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" [ [ -9.420103506085896e-09 -3.694726633398394e-09 -6.126491082329185e-09 ] [ 1.388324333944437e-09 5.642819595335597e-10 1.056635978092352e-08 ] [ -6.139182403995528e-09 -1.130247758630282e-08 -1.177017681434598e-08 ] [ 9.574344728934988e-10 -4.302094166400845e-10 2.089379529370557e-08 ] [ 4.848620323969712e-09 3.235277974081696e-09 -1.31524939472684e-08 ] [ 6.698401805842682e-09 -5.983039077062222e-09 1.46296737148611e-08 ] [ 9.070851112788864e-11 5.639997681653383e-09 -6.409300570290992e-09 ] [ 1.575796302085542e-09 1.197089493791722e-08 -8.631366695690969e-09 ] ] "source-value" [ [ -5.8795662 -2.306067 -3.823855 ] [ 0.8665239 0.3521971 6.5950031 ] [ -3.8317763 -7.0544517 -7.3463666 ] [ 0.5975836 -0.2685156 13.0408814 ] [ 3.0262708 2.0193017 -8.2091411 ] [ 4.1808136 -3.7343193 9.1311242 ] [ 0.0566158 3.5202097 -4.0003708 ] [ 0.9835347 7.471645 -5.3872754 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.899400691264042e-18 "source-value" -24.338145 } }