{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5517358 0.6976041 -0.2451963 ] [ -0.5467092 1.2466678 -1.3987776 ] [ 0.1641712 0.0045297 0.965839 ] [ 0.1222863 -0.6133336 -0.6213135 ] [ 0.945074 0.768761 3.5761508 ] [ -1.722482 0.3326452 -0.9780389 ] [ -0.5687264 -1.1082369 -1.2193641 ] [ 1.0546503 -1.3286374 -0.0792993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.839781996183847e-10 1.117684979594225e-09 -3.928477793666631e-10 ] [ -8.759246986162714e-10 1.99738200306417e-09 -2.241088768418734e-09 ] [ 2.630312584486809e-10 7.25737943923776e-12 1.547444665256851e-09 ] [ 1.959242509041351e-10 -9.82668754671099e-10 -9.954539638874209e-10 ] [ 1.514175467725939e-09 1.231690901182829e-09 5.729625204215218e-09 ] [ -2.759720390148826e-09 5.329563624613401e-10 -1.566991059812949e-09 ] [ -9.112001417117492e-10 -1.775591251487868e-09 -1.953636653262833e-09 ] [ 1.689736053779706e-09 -2.128711779800498e-09 -1.270514845058055e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -33.995839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.446733845028085e-18 } }