{ "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" [ [ -1.80103910340902e-09 2.155900556837812e-09 2.423494493867207e-09 ] [ 1.933161316701995e-09 -1.984820457704112e-09 -1.153731870732618e-09 ] [ 3.306516194042974e-09 7.059628546768251e-09 -4.941109814629283e-09 ] [ 1.430876703033926e-09 -1.466615655825802e-09 -1.901003068439946e-09 ] [ 5.121259835613331e-10 2.367876534652756e-09 7.861967195803124e-10 ] [ -4.643962448087934e-09 -7.441344242755934e-09 3.458608577608249e-09 ] [ -4.606573093158973e-09 -2.898619490112461e-09 -1.351474752319023e-09 ] [ 3.8688944473157e-09 2.207994047921827e-09 2.67901955484744e-09 ] ] "source-value" [ [ -1.1241202 1.3456073 1.5126263 ] [ 1.2065844 -1.2388275 -0.7201028 ] [ 2.0637651 4.4062736 -3.0839982 ] [ 0.893083 -0.9153895 -1.1865128 ] [ 0.3196439 1.4779123 0.4907054 ] [ -2.8985334 -4.6445218 2.1586937 ] [ -2.8751968 -1.809176 -0.8435242 ] [ 2.414774 1.3781215 1.6721125 ] ] } "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" -5.702712321992004e-18 "source-value" -35.593531 } }