{ "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" [ [ -0.6456639 0.4156845 0.6286207 ] [ 0.7434461 -0.0593481 -0.7264273 ] [ 0.885094 0.8312917 -1.0892965 ] [ 0.4553195 0.1022799 -0.4326569 ] [ -0.0212104 0.6351015 0.1053171 ] [ -1.5365011 -1.8175667 0.4475551 ] [ -1.1519727 -1.1471963 -0.083288 ] [ 1.2714885 1.0397534 1.1501758 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.034467605474549e-09 6.659999875289376e-10 1.007161388890931e-09 ] [ 1.191131960244939e-09 -9.508613830890048e-11 -1.163864836770868e-09 ] [ 1.418076914010355e-09 1.331876126805087e-09 -1.745245385419267e-09 ] [ 7.295022578943456e-10 1.638704645577619e-10 -6.931927700078035e-10 ] [ -3.398280699781633e-11 1.017544775135011e-09 1.687365953904557e-10 ] [ -2.461746140253483e-09 -2.912062873484607e-09 7.17062317739806e-10 ] [ -1.845663727739852e-09 -1.838011091328263e-09 -1.334420863931904e-10 ] [ 2.037149148316061e-09 1.665868588877311e-09 1.842784776569936e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 654.7714 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.049059429048485e-16 } }