{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 8.613208899999998 -3.631049899999999 -2.1874351999999995 ] [ 1.0882151999999998 1.0561480999999997 2.0513313999999996 ] [ 2.3422013999999995 -4.802857199999999 5.107844399999999 ] [ -5.404151999999999 6.448406699999998 -2.8293915999999997 ] [ -1.0811056999999997 -1.1549610999999997 2.3042147999999996 ] [ -2.7512272999999996 4.419961299999999 -4.948155599999999 ] [ 0.8519219999999997 -6.887544199999998 -0.6579797999999999 ] [ -3.659062399999999 4.5518963999999995 1.1595715999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.379988192964648e-08 -5.817583258738176e-09 -3.504657536954972e-09 ] [ 1.743512951839196e-09 1.69213579392234e-09 3.286595210592933e-09 ] [ 3.752620324285029e-09 -7.695025518880949e-09 8.183668880364202e-09 ] [ -8.658405989649561e-09 1.033148645615008e-08 -4.533185072607905e-09 ] [ -1.732122277153618e-09 -1.850451672353451e-09 3.691759081861347e-09 ] [ -4.407952058566707e-09 7.081558659700773e-09 -7.927819218400595e-09 ] [ 1.364929511145177e-09 -1.103506229196664e-08 -1.05419985251866e-09 ] [ -5.862464231328336e-09 7.292941992383685e-09 1.857838507663649e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.929926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.712473162907406e-18 } }