{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9511505 0.1387129 -2.4623792 ] [ 0.1394677 -0.8880948 2.4388463 ] [ -0.0067614 -1.7209816 -0.3924798 ] [ 0.3698822 0.8893232 3.9038825 ] [ -0.6624093 1.5216565 -1.3218931 ] [ -0.8118387 0.9462703 0.5245578 ] [ 0.6956697 -0.3789327 -2.7574137 ] [ -1.6751607 -0.5079538 0.0668793 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.12608771476223e-09 2.222425653833683e-10 -3.945166385784207e-09 ] [ 2.234518882967482e-10 -1.422884725614052e-09 3.907462523584583e-09 ] [ -1.083295700387712e-11 -2.757316484346977e-09 -6.288219596962598e-10 ] [ 5.926166132900698e-10 1.424852839375042e-09 6.254709271850256e-09 ] [ -1.061296693860493e-09 2.437962469188355e-09 -2.117906220016837e-09 ] [ -1.300708985000665e-09 1.516092151617402e-09 8.404342434182821e-10 ] [ 1.11458572913895e-09 -6.071171127966201e-10 -4.417863764013625e-09 ] [ -2.683903309622962e-09 -8.138317028065191e-10 1.071524508754695e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.945692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.75913473408776e-18 } }