{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9407972 0.3276156 -0.2101703 ] [ -8.1039632 -5.073771 2.8631688 ] [ 1.0883544 -1.1303886 -2.0952147 ] [ 0.6640753 2.4577388 1.8366153 ] [ 1.0518376 -2.1875463 3.6063598 ] [ -0.6774301 -1.4118691 1.5194374 ] [ 2.9194162 3.1620376 -7.3415576 ] [ 2.1169127 3.856183 -0.1786386 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.507323278754102e-09 5.248980549293645e-10 -3.367299410465223e-10 ] [ -1.298398037486356e-08 -8.129077275493037e-09 4.587302112763991e-09 ] [ 1.743735974824812e-09 -1.811082187338843e-09 -3.356904007896486e-09 ] [ 1.063965920110746e-09 3.937731645393047e-09 2.942582095063578e-09 ] [ 1.685229611598382e-09 -3.504835538777544e-09 5.778025357752964e-09 ] [ -1.085362668446206e-09 -2.262063663649938e-09 2.434407079049138e-09 ] [ 4.677420382024777e-09 5.066142716810542e-09 -1.176247194697656e-08 ] [ 3.391668036214604e-09 6.178286248126407e-09 -2.862105884924429e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.439864 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.954391899153157e-18 } }