{ "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" [ [ 0.7422922 -4.1400905 -0.440759 ] [ 0.0509867 1.8735578 1.1017494 ] [ 1.8755944 -1.2563262 2.2126325 ] [ -2.2558178 3.2940644 -4.6037725 ] [ -0.6711426 -1.4907424 1.8933916 ] [ -0.878352 4.2353512 -2.4170925 ] [ 3.9295597 -3.9509412 4.2672716 ] [ -2.7931205 1.435127 -2.013421 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.189283208642198e-09 -6.633156207096183e-09 -7.061737652071872e-10 ] [ 8.168969871174337e-11 3.001770504877482e-09 1.765197130660428e-09 ] [ 3.005033497783404e-09 -2.012856465738505e-09 3.545028061922256e-09 ] [ -3.61421853994449e-09 5.277672969089579e-09 -7.376056666981968e-09 ] [ -1.075288982942926e-09 -2.388432620915282e-09 3.033547755539106e-09 ] [ -1.407275039232922e-09 6.785780673517226e-09 -3.872609093811024e-09 ] [ 6.295848681377862e-09 -6.330105620795497e-09 6.836922792123809e-09 ] [ -4.475072364177207e-09 2.299326927278842e-09 -3.225856054027757e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.397358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.190628956328785e-18 } }