{ "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" [ 5.51396 0 0 ] "si-unit" "m" "si-value" [ 5.51396e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0181329 5.46551 0 ] "si-unit" "m" "si-value" [ 1.81329e-12 5.46551e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.147171 -0.00272143 5.46493 ] "si-unit" "m" "si-value" [ 1.47171e-11 -2.72143e-13 5.46493e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0812176 -0.117418 -0.0378641 ] [ 1.41633 1.35692 1.32004 ] [ 0.0825096 2.73802 2.72856 ] [ 1.5042 4.09281 4.08646 ] [ 2.79856 -0.0135645 2.62504 ] [ 4.22175 1.43085 4.07963 ] [ 2.7526 2.68069 -0.168753 ] [ 4.2604 4.00574 1.18537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.12176e-12 -1.17418e-11 -3.78641e-12 ] [ 1.41633e-10 1.35692e-10 1.32004e-10 ] [ 8.25096e-12 2.73802e-10 2.72856e-10 ] [ 1.5042e-10 4.09281e-10 4.08646e-10 ] [ 2.79856e-10 -1.35645e-12 2.62504e-10 ] [ 4.22175e-10 1.43085e-10 4.07963e-10 ] [ 2.7526e-10 2.68069e-10 -1.68753e-11 ] [ 4.2604e-10 4.00574e-10 1.18537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6362944 2.8281404 -1.1035351 ] [ -0.5332666 -0.3191768 -0.6330514 ] [ 0.2421911 0.1511213 -0.6182647 ] [ -0.0632444 -0.1400619 -1.0127628 ] [ 0.9539984 -0.1969878 0.3699124 ] [ 0.9187324 -2.6108465 -1.4855011 ] [ -0.8484104 1.2263039 2.2607083 ] [ -2.3062948 -0.9384926 2.2224943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.621632654025049e-09 4.531180466551413e-09 -1.768058152018853e-09 ] [ -8.543872862126243e-10 -5.113776110748912e-10 -1.014260161200988e-09 ] [ 3.880329213827573e-10 2.421230157597042e-10 -9.905692559670197e-10 ] [ -1.013286999113496e-10 -2.244039034936445e-10 -1.622624893944415e-09 ] [ 1.528473945353386e-09 -3.156092503430652e-10 5.926650039068614e-10 ] [ 1.471971584178741e-09 -4.183037257260681e-09 -2.380035152201297e-09 ] [ -1.359303318922593e-09 1.964755454763072e-09 3.622054014549862e-09 ] [ -3.695091639675703e-09 -1.503630914901908e-09 3.560828436658186e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.1983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.79960704505222e-18 } }