{ "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" [ [ 0.5468857 -2.7585115 -0.271386 ] [ 0.4116056 1.181175 1.0131034 ] [ 1.43258 -1.042292 1.7219413 ] [ -2.7467085 3.0416875 -3.7353782 ] [ -0.5447528 -0.6676844 1.071274 ] [ -0.9244389 2.7351536 -1.5988685 ] [ 3.8365379 -3.342808 3.4738907 ] [ -2.011709 0.8532798 -1.6745767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.762074827898427e-10 -4.419622633507939e-09 -4.348083044124288e-10 ] [ 6.594648693103566e-10 1.89245097007344e-09 1.623170581932991e-09 ] [ 2.295246183425664e-09 -1.669935874446874e-09 2.758854093249959e-09 ] [ -4.400712142852637e-09 4.8733206002796e-09 -5.984735621885987e-09 ] [ -8.727902002753383e-10 -1.069748335752875e-09 1.716370157270899e-09 ] [ -1.481114392938069e-09 4.382199152216955e-09 -2.561669730433565e-09 ] [ 6.146811328193129e-09 -5.355768825423207e-09 5.565786462754547e-09 ] [ -3.223113127652948e-09 1.3671049465609e-09 -2.682967638476415e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.346356 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.663110521367381e-18 } }