{ "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" [ [ 1.1538269000000003 1.9993380000000005 2.5869639000000006 ] [ -1.3800876000000002 -0.9956590000000002 0.7647596000000002 ] [ 0.4116303000000001 -1.7220044000000005 0.2853335000000001 ] [ 1.2081913000000002 -0.9104853000000003 -0.5830792000000001 ] [ -1.5913653000000005 0.4849653000000001 0.18224940000000003 ] [ -0.4523279000000001 1.7437349000000004 -0.7062138000000001 ] [ 1.2084925000000002 0.6116046000000002 -1.1896708000000003 ] [ -0.5583602000000001 -1.2114943000000002 -1.3403425000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.848634498860655e-09 3.203292627068292e-09 4.144773113581513e-09 ] [ -2.211144105593138e-09 -1.595221585231806e-09 1.225279961747187e-09 ] [ 6.595044485064102e-10 -2.75895521332519e-09 4.571546665974391e-10 ] [ 1.935735870262084e-09 -1.45875827326048e-09 -9.341958700114128e-10 ] [ -2.549648299818401e-09 7.770000719608003e-10 2.919957302405196e-10 ] [ -7.247091922862887e-10 2.793771312670327e-09 -1.131479248968349e-09 ] [ 1.936218445864245e-09 9.798985993669166e-10 -1.906062757912087e-09 ] [ -8.945916657955668e-10 -1.941027859684186e-09 -2.147465435057145e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.01898 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.770876813651331e-18 } }