{ "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" [ 5.44188 0 0 ] "si-unit" "m" "si-value" [ 5.44188e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0681259 5.43851 0 ] "si-unit" "m" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00252152 -0.017859 5.5414 ] "si-unit" "m" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00431502 -0.0137584 0.0307734 ] [ 1.33409 1.32426 1.37744 ] [ 0.0396224 2.60036 2.83022 ] [ 1.35045 4.04355 3.98016 ] [ 2.67673 0.013858 2.80413 ] [ 4.08887 1.41719 3.918 ] [ 2.72143 2.70354 0.017408 ] [ 3.9766 4.07774 1.36794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.31502e-13 -1.37584e-12 3.07734e-12 ] [ 1.33409e-10 1.32426e-10 1.37744e-10 ] [ 3.962240000000001e-12 2.60036e-10 2.83022e-10 ] [ 1.35045e-10 4.04355e-10 3.98016e-10 ] [ 2.67673e-10 1.3858e-12 2.80413e-10 ] [ 4.08887e-10 1.41719e-10 3.918e-10 ] [ 2.72143e-10 2.70354e-10 1.7408e-12 ] [ 3.9766e-10 4.077740000000001e-10 1.36794e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9285351 1.8164475 -7.4959893 ] [ 0.4915545 0.1800066 -0.1274895 ] [ -2.7050316 5.4744734 -6.4674081 ] [ -2.1827601 1.3944489 5.1312602 ] [ 0.8705781 0.0105247 -2.1587029 ] [ 1.831019 -5.4603113 8.4447024 ] [ -0.4906629 -0.258039 -1.364001 ] [ 4.1138381 -3.1575508 4.0376282 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.089853875068853e-09 2.910269741387715e-09 -1.200989890517401e-08 ] [ 7.875571342375529e-10 2.884023684857843e-10 -2.04260697980343e-10 ] [ -4.333938423751634e-09 8.771073364934535e-09 -1.036193014036234e-08 ] [ -3.497167229847503e-09 2.234153444887002e-09 8.221185195414166e-09 ] [ 1.394819889892115e-09 1.68624284198598e-11 -3.458623346128039e-09 ] [ 2.933615858210045e-09 -8.748383179226164e-09 1.352990486636372e-08 ] [ -7.861286335506785e-10 -4.13424056460726e-10 -2.185370530952634e-09 ] [ 6.591095279878954e-09 -5.058954112428007e-09 6.468993558819479e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.142633 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.630470544983732e-18 } }