{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.505766 -2.2914818 -0.1957433 ] [ 0.1705395 1.1231198 0.6534895 ] [ 1.1606155 -0.8500365 1.4580945 ] [ -1.7403756 2.1379068 -2.8191064 ] [ -0.4475249 -0.8168594 1.0484217 ] [ -0.6835807 2.3466909 -1.3427837 ] [ 2.7071186 -2.3585155 2.5464146 ] [ -1.6725585 0.7091757 -1.348787 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.103264607955329e-10 -3.671358566948702e-09 -3.136153389382407e-10 ] [ 2.732343998229216e-10 1.799436285917572e-09 1.047005598838282e-09 ] [ 1.859511019838102e-09 -1.361908607126659e-09 2.336124918817066e-09 ] [ -2.788389097730773e-09 3.425304292409341e-09 -4.516706365627653e-09 ] [ -7.170139320058579e-10 -1.308753033160716e-09 1.679756736479391e-09 ] [ -1.095217015970099e-09 3.759813296224111e-09 -2.151376650931321e-09 ] [ 4.337282130652826e-09 -3.778758393894423e-09 4.079805938983783e-09 ] [ -2.679734125620317e-09 1.136224726579474e-09 -2.160994997838969e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.592371 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.619696862463992e-18 } }