{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] "source-value" [ 5.40103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] "source-value" [ -0.134454 5.44836 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] "source-value" [ -0.122267 -0.177468 5.33534 ] } "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" [ [ 1.120964474919341e-10 2.763517548740122e-10 4.521095688697997e-10 ] [ -7.063732361964768e-10 -5.725068934340987e-10 2.486441930468832e-10 ] [ 5.258600017724928e-11 -1.258757432143976e-09 -2.609771078031533e-10 ] [ 1.167198165230442e-09 -1.487965460386272e-10 3.05711321014848e-11 ] [ -1.040247457634085e-09 4.297984583368492e-10 -2.923073511875731e-10 ] [ 1.743565503232358e-10 1.379886470770994e-09 2.845822963927239e-10 ] [ 5.556076150908864e-11 -3.578797939647168e-11 -3.942873350604518e-10 ] [ 1.848227690986118e-10 -7.018751253335809e-11 -6.833555657737536e-11 ] ] "source-value" [ [ 0.06996510000000002 0.17248520000000003 0.28218460000000006 ] [ -0.4408835000000001 -0.35733070000000006 0.15519150000000004 ] [ 0.032821600000000006 -0.7856546000000002 -0.16288910000000004 ] [ 0.7285078000000001 -0.09287150000000001 0.019081000000000004 ] [ -0.6492714000000002 0.26825910000000003 -0.18244390000000002 ] [ 0.10882480000000003 0.8612574000000002 0.17762230000000004 ] [ 0.03467830000000001 -0.022337100000000002 -0.24609480000000006 ] [ 0.11535730000000002 -0.04380760000000001 -0.04265170000000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.2652e-11 -1.01854e-11 -4.28595e-12 ] [ 1.30252e-10 1.39257e-10 1.42794e-10 ] [ -1.34723e-11 2.79807e-10 2.80389e-10 ] [ 1.19895e-10 4.084240000000001e-10 4.16214e-10 ] [ 2.70678e-10 2.24968e-12 2.81634e-10 ] [ 3.95472e-10 1.30925e-10 4.227070000000001e-10 ] [ 2.581e-10 2.82078e-10 2.50931e-11 ] [ 3.97059e-10 4.21723e-10 1.58759e-10 ] ] "source-value" [ [ -0.12652 -0.101854 -0.0428595 ] [ 1.30252 1.39257 1.42794 ] [ -0.134723 2.79807 2.80389 ] [ 1.19895 4.08424 4.16214 ] [ 2.70678 0.0224968 2.81634 ] [ 3.95472 1.30925 4.22707 ] [ 2.581 2.82078 0.250931 ] [ 3.97059 4.21723 1.58759 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.481869799046055e-17 "source-value" 154.90613 } }