{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4611389 -0.4919888 -1.8237304 ] [ -0.3150924 -0.1002746 0.5735887 ] [ -0.0347057 -0.4922643 -0.9865255 ] [ -1.5059251 -1.1544131 4.4931133 ] [ 1.8759809 1.0658931 -2.4557435 ] [ -0.7663894 0.5055704 2.3755991 ] [ 0.4074889 -0.1604969 -2.8139067 ] [ -0.1224962 0.8279743 0.637605 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.388259645214291e-10 -7.88252953055447e-10 -2.921938209522233e-09 ] [ -5.048336766717619e-10 -1.606576197800717e-10 9.18990405095065e-10 ] [ -5.560466114849856e-11 -7.886943527144775e-10 -1.580588091923031e-09 ] [ -2.412757987895902e-09 -1.849573679565252e-09 7.198761083865537e-09 ] [ 3.005652739047343e-09 1.707749005092036e-09 -3.934534822381565e-09 ] [ -1.22789117910894e-09 8.100130750485042e-10 3.806129338413522e-09 ] [ 6.528691888155092e-10 -2.571443808908756e-10 -4.508375527852479e-09 ] [ -1.962605477768409e-10 1.326561066083245e-09 1.021555824305184e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.510436 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.689399035361467e-18 } }