{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.40034e-10 0.0 0.0 ] "source-value" [ 5.40034 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.804290000000001e-13 5.477140000000001e-10 0.0 ] "source-value" [ -0.00680429 5.47714 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.50519e-12 4.28382e-14 5.30288e-10 ] "source-value" [ 0.0750519 0.000428382 5.30288 ] } "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" [ [ 1.243639613985431e-09 3.179266680506838e-09 9.834998036843078e-10 ] [ -2.478018166449651e-09 -7.174082276722368e-10 -4.182567624829951e-09 ] [ 3.120314111091516e-09 3.185369371255465e-09 -2.815495843325102e-09 ] [ -1.378390198024829e-09 -3.156439989537314e-09 4.193877389596178e-09 ] [ -5.475227114270054e-10 3.583071104912504e-09 2.505106967665828e-09 ] [ 4.83925431987984e-10 -5.191472342101974e-09 2.679490434556293e-09 ] [ -3.255117246524076e-09 9.292468989507782e-10 -1.997750824122279e-09 ] [ 2.811169165360632e-09 -1.811633816749384e-09 -1.366160303225276e-09 ] ] "source-value" [ [ 0.7762188 1.9843422 0.6138523 ] [ -1.5466573 -0.447771 -2.6105534 ] [ 1.9475469 1.9881512 -1.7572943 ] [ -0.8603235 -1.9700949 2.6176124 ] [ -0.3417368 2.2363771 1.5635648 ] [ 0.3020425 -3.2402622 1.6724064 ] [ -2.0316844 0.5799903 -1.246898 ] [ 1.7545938 -1.1307329 -0.8526902 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.429230000000001e-12 -5.51564e-12 1.07349e-12 ] [ 1.38568e-10 1.34449e-10 1.49834e-10 ] [ -6.27007e-12 2.68919e-10 2.77312e-10 ] [ 1.41517e-10 4.13638e-10 3.9375e-10 ] [ 2.74489e-10 -6.43812e-12 2.6522e-10 ] [ 4.025610000000001e-10 1.44985e-10 4.00224e-10 ] [ 2.7219e-10 2.73875e-10 1.36559e-11 ] [ 4.01026e-10 4.10579e-10 1.40939e-10 ] ] "source-value" [ [ -0.0542923 -0.0551564 0.0107349 ] [ 1.38568 1.34449 1.49834 ] [ -0.0627007 2.68919 2.77312 ] [ 1.41517 4.13638 3.9375 ] [ 2.74489 -0.0643812 2.6522 ] [ 4.02561 1.44985 4.00224 ] [ 2.7219 2.73875 0.136559 ] [ 4.01026 4.10579 1.40939 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.752759833531259e-18 "source-value" -35.905903 } }