{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43103e-10 0.0 0.0 ] "source-value" [ 5.43103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] "source-value" [ 0.00138287 5.43667 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] "source-value" [ -0.0279747 -0.147199 5.47761 ] } "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" [ [ 3.878089018507147e-09 -2.06704816732512e-10 -6.377791203560368e-09 ] [ 1.948529555066371e-09 4.783348129091307e-09 -1.457207674708464e-09 ] [ 2.718479082188137e-09 9.746873516169216e-11 2.229052256337312e-09 ] [ 2.115253976838764e-09 -4.821486181155169e-10 1.529314915268865e-09 ] [ 5.851105760392838e-10 -1.58583522035615e-09 6.242147566272535e-09 ] [ -2.278332805928189e-09 -4.612183435032029e-09 -2.765658377140834e-09 ] [ -5.357934968214528e-09 1.722085922365603e-09 -1.382268586970799e-09 ] [ -3.609194274279323e-09 2.839694638352679e-10 1.982410944284091e-09 ] ] "source-value" [ [ 2.4205128 -0.129015 -3.9807042 ] [ 1.2161765 2.9855311 -0.9095175 ] [ 1.6967412 0.0608352 1.391265 ] [ 1.3202377 -0.3009335 0.9545233 ] [ 0.3651973 -0.9898005 3.8960421 ] [ -1.4220235 -2.8786985 -1.7261882 ] [ -3.34416 1.0748415 -0.8627442 ] [ -2.2526819 0.1772398 1.2373236 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.650273241410883e-18 "source-value" -35.266232 } }