{ "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" [ 5.4484 0 0 ] "si-unit" "m" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00476084 5.4399 0 ] "si-unit" "m" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0697031 -0.0639637 5.39979 ] "si-unit" "m" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00902537 -0.0303023 -0.0491559 ] [ 1.28054 1.44048 1.35481 ] [ -0.0535965 2.57981 2.82719 ] [ 1.28029 4.0563 4.12138 ] [ 2.62772 -0.0777145 2.68834 ] [ 4.08246 1.48548 4.03991 ] [ 2.84369 2.84518 0.0189163 ] [ 4.03071 4.03913 1.36727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.02537e-13 -3.03023e-12 -4.91559e-12 ] [ 1.28054e-10 1.44048e-10 1.35481e-10 ] [ -5.35965e-12 2.57981e-10 2.82719e-10 ] [ 1.28029e-10 4.0563e-10 4.12138e-10 ] [ 2.62772e-10 -7.771450000000001e-12 2.68834e-10 ] [ 4.08246e-10 1.48548e-10 4.03991e-10 ] [ 2.84369e-10 2.84518e-10 1.89163e-12 ] [ 4.03071e-10 4.03913e-10 1.36727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0806336 1.8948081 1.7143738 ] [ 1.6402386 -1.9935959 -0.5192622 ] [ 1.2290991 4.4555356 -2.7818091 ] [ 1.1044388 -0.8534629 -1.256697 ] [ 0.2886049 2.0850775 0.4332893 ] [ -2.2794291 -4.9703668 1.3860779 ] [ -3.2026025 -1.7454558 -0.3236729 ] [ 2.3002837 1.1274602 1.3477003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.731365889570939e-09 3.035817238722469e-09 2.746729621672055e-09 ] [ 2.627951937453723e-09 -3.194092742302735e-09 -8.319497569051738e-10 ] [ 1.969233842666321e-09 7.138554971462101e-09 -4.456949503548689e-09 ] [ 1.769506024464407e-09 -1.367398305100168e-09 -2.013450552829498e-09 ] [ 4.623960234283219e-10 3.340662423056112e-09 6.942059865027975e-10 ] [ -3.652048012791186e-09 -7.963405483760509e-09 2.220741605987561e-09 ] [ -5.131134851215632e-09 -2.796528475399761e-09 -5.185811531665363e-10 ] [ 3.685460765347321e-09 1.806390373322492e-09 2.159253912505146e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.105656 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.304110805944725e-18 } }