{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43079e-10 0.0 0.0 ] "source-value" [ 5.43079 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] "source-value" [ -0.0839771 5.43297 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] "source-value" [ 0.0398452 0.0785902 5.46584 ] } "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" [ [ 5.531872068698439e-09 5.808189697210428e-09 -6.61879413564967e-09 ] [ -1.296636252030591e-09 8.298416129075252e-10 7.227689504277714e-10 ] [ -1.5314898700316e-09 -1.963402881072582e-09 -3.816880263974413e-09 ] [ -9.114304706227553e-09 -1.062828006209355e-08 1.492612429479006e-08 ] [ 1.258181065126409e-08 1.237397437740197e-08 -1.125700140509803e-08 ] [ 5.20128535346905e-10 -2.765029042164184e-09 -3.632081527525114e-10 ] [ -1.195557172071589e-09 2.298704641879323e-09 4.655829129447552e-10 ] [ -5.495823254948101e-09 -5.953998664504248e-09 5.941408119747354e-09 ] ] "source-value" [ [ 3.452723 3.6251869 -4.1311264 ] [ -0.8092967 0.5179464 0.4511169 ] [ -0.9558808 -1.2254597 -2.3823093 ] [ -5.6887016 -6.6336507 9.3161541 ] [ 7.8529486 7.7232274 -7.0260677 ] [ 0.3246387 -1.7257954 -0.2266967 ] [ -0.7462081 1.4347386 0.290594 ] [ -3.4302231 -3.7161937 3.7083353 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.812299199567895e-18 "source-value" -61.243555 } }