{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] "source-value" [ 5.4484 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] "source-value" [ 0.00476084 5.4399 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] "source-value" [ -0.0697031 -0.0639637 5.39979 ] } "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" [ [ -1.099096045786717e-09 8.252377583876562e-10 1.175385768415717e-09 ] [ 1.335815238244986e-09 -2.601143356928525e-10 -1.267259863035237e-09 ] [ 1.680851023111398e-09 1.538800121299325e-09 -2.04711036102056e-09 ] [ 8.158067059269791e-10 2.332442315854157e-10 -8.098278634311398e-10 ] [ -1.56460557904224e-11 1.211011767755825e-09 1.317540331055155e-10 ] [ -2.85851877168812e-09 -3.435378298347945e-09 8.314106244722747e-10 ] [ -2.062015089688539e-09 -2.049703323663664e-09 -8.964178193376e-11 ] [ 2.202802675235111e-09 1.936902078676239e-09 2.075289603644854e-09 ] ] "source-value" [ [ -0.6860018 0.5150729 0.7336181 ] [ 0.8337503 -0.1623506 -0.7909614 ] [ 1.0491047 0.9604435 -1.2777058 ] [ 0.5091865 0.1455796 -0.5054548 ] [ -0.0097655 0.7558541 0.0822344 ] [ -1.7841471 -2.1441945 0.5189257 ] [ -1.2870086 -1.2793242 -0.05595 ] [ 1.3748813 1.2089192 1.2952939 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.456938809302773e-17 "source-value" 153.35006 } }