{ "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" [ [ -3.270444629384621e-09 1.351878020174479e-09 -1.336523079876056e-09 ] [ -4.232997095275604e-10 -2.374453790116464e-09 5.032684302220714e-09 ] [ 2.693531269590336e-11 1.376454127796254e-09 -2.981409563727369e-09 ] [ 3.037563771456803e-09 -5.787191730635885e-10 -1.824889905674559e-09 ] [ -2.143821266640615e-10 7.851971215865952e-10 7.440170167728211e-10 ] [ -3.380707545951712e-09 -2.409418571165169e-09 2.958468637564783e-09 ] [ 2.537213305405364e-10 -5.475372912342548e-10 -7.388950183337856e-09 ] [ 3.970613436617049e-09 2.396599556022147e-09 4.796602615839862e-09 ] ] "source-value" [ [ -2.041251 0.8437759 -0.8341921 ] [ -0.2642029 -1.4820175 3.1411545 ] [ 0.0168117 0.8591151 -1.8608495 ] [ 1.8958982 -0.3612081 -1.1390067 ] [ -0.1338068 0.4900815 0.4643789 ] [ -2.1100717 -1.5038408 1.8465309 ] [ 0.1583604 -0.3417459 -4.61182 ] [ 2.478262 1.4958398 2.9938039 ] ] } "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" -5.727389687176215e-18 "source-value" -35.747555 } }