{ "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" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.80477 -0.3478288 1.0341943 ] [ -4.2316889 -0.7682971 3.5667904 ] [ 2.7910016 -5.4242044 0.6191751 ] [ -0.3490233 1.4502922 0.0687201 ] [ -1.8859262 0.9749537 1.2568756 ] [ -0.9468887 2.3174466 1.6788314 ] [ 5.2857481 1.6324946 -3.2247565 ] [ -1.4679924 0.1651431 -4.9998306 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.289383679121216e-09 -5.572831714009191e-10 1.656961928824622e-09 ] [ -6.77991302207887e-09 -1.23094765144844e-09 5.71462819017388e-09 ] [ 4.471677512135393e-09 -8.69053347612049e-09 9.920278694015021e-10 ] [ -5.591969713744645e-10 2.323624256168598e-09 1.101017375990381e-10 ] [ -3.021586866194185e-09 1.562048024502457e-09 2.013736701573972e-09 ] [ -1.517082937639705e-09 3.712958762472449e-09 2.689784419344933e-09 ] [ 8.46870202925802e-09 2.615544681702248e-09 -5.166629472072834e-09 ] [ -2.351983102792082e-09 2.645884139064365e-10 -8.010611695280437e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.391983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.670420772635105e-18 } }