{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.320235 0.3123759 -0.6120377 ] [ 4.5694016 5.4481026 -2.8197103 ] [ 1.5528609 -0.7828601 0.2443646 ] [ -0.662797 0.065039 -2.4494788 ] [ -0.0066047 -0.4999868 -0.7653032 ] [ 1.688031 -0.2767932 -1.193669 ] [ -3.9271291 -4.5225304 6.3945328 ] [ -0.8935277 0.2566528 1.2013017 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.717426302388989e-09 5.004813680047205e-10 -9.805925020671016e-10 ] [ 7.320988474882214e-09 8.728822685354648e-09 -4.51767395730913e-09 ] [ 2.48795744983221e-09 -1.254280159910903e-09 3.915152522967564e-10 ] [ -1.061917866485298e-09 1.04203966098726e-10 -3.924497698838359e-09 ] [ -1.05818960145798e-11 -8.010671682684311e-10 -1.226150904965429e-09 ] [ 2.704523825667654e-09 -4.434715974900888e-10 -1.912468580530146e-09 ] [ -6.291954482721448e-09 -7.245892533434672e-09 1.024517103750659e-08 ] [ -1.431589202771762e-09 4.112031192106752e-10 1.924697514124477e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.730651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.724681414980873e-18 } }