{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43593e-10 0.0 0.0 ] "source-value" [ 5.43593 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] "source-value" [ 0.00214695 5.43123 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] "source-value" [ -0.0452237 0.0446124 5.47348 ] } "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" [ [ 3.044441915689897e-09 7.496010829492953e-10 -3.341286631067575e-09 ] [ -1.299315571993555e-10 -1.244857588652563e-09 3.641326246844792e-09 ] [ 1.384969536318144e-11 -2.751852421199401e-09 -6.57755507073625e-10 ] [ 1.000302951430272e-09 1.366454142417531e-09 5.547596791360942e-09 ] [ -8.401537022919802e-10 2.068275755051977e-09 -1.901440783092749e-09 ] [ -1.084726604327749e-09 1.078395603410657e-09 4.637968064478874e-10 ] [ 9.048987810621427e-10 -3.888008414401843e-10 -3.840147873949981e-09 ] [ -2.908681639944071e-09 -8.772158927549741e-10 8.791111074797184e-11 ] ] "source-value" [ [ 1.9001912 0.4678642 -2.0854671 ] [ -0.0810969 -0.776979 2.2727371 ] [ 0.0086443 -1.7175712 -0.4105387 ] [ 0.62434 0.8528736 3.4625376 ] [ -0.5243827 1.2909162 -1.186786 ] [ -0.6770331 0.6730816 0.2894792 ] [ 0.5647934 -0.2426704 -2.3968318 ] [ -1.8154563 -0.5475151 0.0548698 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.767572757478866e-18 "source-value" -35.998358 } }