{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44714e-10 0.0 0.0 ] "source-value" [ 5.44714 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] "source-value" [ 0.103058 5.37075 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] "source-value" [ 0.0454409 0.00880856 5.43207 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.570969424580058e-10 4.440250176847753e-09 3.978675589372915e-10 ] [ 1.904504465227043e-09 -4.004100369950728e-09 -5.876546562736859e-09 ] [ -1.327982356963557e-09 3.756909190881249e-09 7.058635838134004e-09 ] [ 6.703981225706958e-10 -5.044968030154726e-09 2.764169634624787e-10 ] [ -1.74840840250405e-09 2.298388051779053e-09 5.004199684732496e-09 ] [ -1.463735743349914e-10 -1.513545171443317e-09 2.037432252924956e-09 ] [ 1.173743377161734e-10 2.285894278490054e-09 -3.0702233407835e-09 ] [ 6.875841905290311e-10 -2.218827966231677e-09 -5.827782234453205e-09 ] ] "source-value" [ [ -0.09805220000000003 2.7713862000000002 0.24832940000000006 ] [ 1.1886982000000001 -2.4991629000000004 -3.667851900000001 ] [ -0.8288614000000002 2.3448783000000004 4.405654000000001 ] [ 0.4184296000000001 -3.148821400000001 0.17252590000000004 ] [ -1.0912707000000001 1.4345410000000003 3.1233758000000007 ] [ -0.09135920000000002 -0.9446806000000002 1.2716652000000002 ] [ 0.07325930000000001 1.4267430000000003 -1.9162827000000004 ] [ 0.4291563000000001 -1.3848835000000002 -3.637415600000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.254663149332298e-18 "source-value" -32.797028 } }