{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.23298e-10 0.0 0.0 ] "source-value" [ 5.23298 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] "source-value" [ -0.924429 5.53043 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] "source-value" [ -0.629107 -0.473789 5.46851 ] } "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" [ [ 9.462818816537721e-10 -3.740154749304557e-10 -1.689613166832891e-09 ] [ -1.287995777601682e-08 -7.742645091969044e-10 3.425615114673777e-09 ] [ 5.272493452509858e-09 -2.976181821631362e-09 -4.885366084550099e-09 ] [ 2.970422156897247e-09 6.716844941577698e-09 2.621538584658323e-09 ] [ -8.088221771662637e-10 -5.946422612135134e-09 7.737968658848252e-09 ] [ -1.689408088225428e-09 -2.999795982410009e-09 6.65863754450871e-09 ] [ 3.673526952787292e-09 1.711012799086268e-09 -1.059823700740629e-08 ] [ 2.515463597560341e-09 4.642822659639898e-09 -3.270543643899787e-09 ] ] "source-value" [ [ 0.5906227 -0.2334421 -1.0545736 ] [ -8.0390374 -0.4832579 2.1381008 ] [ 3.2908316 -1.8575866 -3.0492057 ] [ 1.8539917 4.1923249 1.6362357 ] [ -0.5048271 -3.7114651 4.8296602 ] [ -1.0544456 -1.8723254 4.1559947 ] [ 2.2928352 1.0679302 -6.6148993 ] [ 1.5700289 2.897822 -2.0413128 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.908601650993251e-18 "source-value" -30.637082 } }