{ "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" [ 5.40103 0 0 ] "si-unit" "m" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.134454 5.44836 0 ] "si-unit" "m" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.122267 -0.177468 5.33534 ] "si-unit" "m" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9648166000000002 1.8448708000000005 2.1498115000000007 ] [ -1.0154787000000003 -0.5810690000000001 0.7283028000000001 ] [ 0.5251765000000002 -1.5340376000000004 0.4364675000000001 ] [ 0.9374762000000002 -1.0668727000000002 -0.4961872000000001 ] [ -1.4194263000000003 0.6380681000000001 0.31315440000000005 ] [ -0.4300853000000001 1.6698121000000004 -0.7296145000000002 ] [ 0.9614119000000002 0.3856952000000001 -1.0738969000000003 ] [ -0.5238911000000002 -1.3564668000000002 -1.3280376000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.545806599879746e-09 2.955808864156594e-09 3.444377724426981e-09 ] [ -1.626976232060378e-09 -9.309751668716354e-10 1.166869719023179e-09 ] [ 8.414255100935715e-10 -2.457799178148143e-09 6.992980242390243e-10 ] [ 1.502002450196425e-09 -1.709318497309773e-09 -7.94979531380214e-10 ] [ -2.274171632808647e-09 1.022297792298277e-09 5.017286583806516e-10 ] [ -6.890726126097544e-10 2.675333907748952e-09 -1.168971294096682e-09 ] [ 1.540351669138908e-09 6.179518321947805e-10 -1.720572506329596e-09 ] [ -8.393660722651952e-10 -2.17329939385139e-09 -2.127750794263342e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.847137 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.743344482401465e-18 } }