{ "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" [ [ 0.8609223000000003 1.7999705000000004 2.4641868000000002 ] [ -1.5780376000000005 -1.0866143000000001 0.9194937000000002 ] [ 0.5651330000000001 -1.8383441000000005 0.4847037000000001 ] [ 1.4608329000000002 -1.0725088000000003 -0.6531610000000001 ] [ -1.6944835000000005 0.6519885000000001 0.36433450000000006 ] [ -0.5391126000000002 2.0521859000000005 -0.7704366000000002 ] [ 1.4819578000000002 0.7935884000000002 -1.3783577000000002 ] [ -0.5572123000000001 -1.3002661000000002 -1.4307634000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.379349581385364e-09 2.883870653229687e-09 3.948062480243966e-09 ] [ -2.528294949463343e-09 -1.740948027286958e-09 1.473191309112889e-09 ] [ 9.054428802425666e-10 -2.945351938005618e-09 7.765809361552571e-10 ] [ 2.340512319275465e-09 -1.718348524962264e-09 -1.046479283818349e-09 ] [ -2.714861848031358e-09 1.044600731730461e-09 5.837282180508577e-10 ] [ -8.637536036987023e-10 3.287964270515408e-09 -1.234375508328642e-09 ] [ 2.374358140172203e-09 1.271468781018079e-09 -2.20837248203966e-09 ] [ -8.92752519882196e-10 -2.083255946238795e-09 -2.292335669376319e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.949837 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.759798836297081e-18 } }