{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.05856e-09 0.0 0.0 ] "source-value" [ 10.5856 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -5.4462e-10 9.064930000000001e-10 0.0 ] "source-value" [ -5.4462 9.06493 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.79622e-11 1.88792e-11 1.03176e-09 ] "source-value" [ -0.279622 0.188792 10.3176 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" 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-0.4707536 0.138669 ] [ 2.60153 -0.7295735 0.2277404 ] [ 0.5085821 -0.0829766 -0.2715208 ] [ 0.403354 -0.4528638 1.0145803 ] [ 0.157021 -0.4180771 -1.0886782 ] [ -0.2199645 0.5716638 0.7531228 ] [ 0.4510305 0.1774248 -1.0274099 ] [ 0.7433969 2.3730118 0.2252678 ] [ -0.0978295 -0.1745027 -0.6543886 ] [ -0.6468999 0.56068 -0.7417681 ] [ 1.0991999 2.1331709 -0.9172034 ] [ -0.3157633 0.1955053 0.0963088 ] [ 1.1720883 0.0814266 0.0388011 ] [ 1.1626286 -0.3054135 -0.4869033 ] [ 0.1518502 -0.1381276 0.767499 ] [ -0.326651 -0.4165108 -0.6168225 ] [ 1.0661936 -1.172846 -1.575251 ] [ -0.0037697 -0.271933 2.342973 ] [ -0.5315788 -0.2840397 -0.6281241 ] [ -2.4224256 -0.4048286 0.076725 ] [ -0.3079388 1.346621 -0.5112632 ] [ -0.5101257 0.1624658 0.2356736 ] [ -0.0546009 0.1335277 0.1771094 ] [ -0.1671932 -0.319783 0.7291237 ] [ -0.5165424 -0.2293915 0.0458861 ] [ 0.0590727 0.1021135 -2.9016675 ] [ -0.2606886 -0.7881214 2.7317799 ] [ 0.5980818 0.0213963 -0.1122098 ] [ -0.1410885 0.1907861 0.5521258 ] [ 0.4826684 0.2706898 -2.2238203 ] [ -0.409923 -0.0485612 1.6200703 ] [ 0.0126054 0.1834743 0.1596826 ] [ -0.4737974 0.0945613 -0.1575687 ] [ -0.1323749 -0.2098923 0.2232842 ] [ 0.6238796 -0.3040775 -0.2247493 ] [ 2.0883691 0.139646 0.5563185 ] [ -0.0850448 0.5012069 -2.340966 ] [ 0.569342 0.5344508 1.7291951 ] [ 0.007307 0.8727669 0.1070975 ] [ 0.6428664 1.4650969 0.6642308 ] [ 0.3044534 -0.413913 0.1588954 ] [ 0.5797963 0.0786021 -0.1441703 ] [ -0.1293716 0.2996591 -0.5252099 ] [ -0.2134679 -0.4934231 -1.5398917 ] [ 0.3230761 -0.1905388 1.508692 ] [ 0.2626113 0.7327174 0.6066992 ] [ 0.2469022 -0.4201174 -0.349545 ] [ 0.1173673 0.4378159 -0.1896027 ] [ -0.1043793 0.1646038 -3.058664 ] [ -1.954946 -0.3421866 2.6176413 ] [ -0.0681161 0.0182863 0.7335372 ] [ -1.2585248 -2.2024701 0.5628976 ] [ -0.0682805 -0.0674085 -0.0790783 ] [ -0.0234229 -0.0546977 0.3081172 ] [ -1.6929532 -1.8150137 0.7552515 ] [ 0.1864798 -0.187409 -0.1391321 ] [ 0.1991206 -0.0833437 -0.7902951 ] [ -0.404529 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4.85785 0.331316 ] [ 5.18105 4.71119 2.66831 ] [ 5.11347 4.91069 5.65221 ] [ 5.26259 5.22511 8.02551 ] [ 3.84325 6.8985 0.290269 ] [ 3.8973 7.01822 2.77996 ] [ 3.85324 7.1029 5.03452 ] [ 3.69095 7.15117 7.82626 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.88802667921532e-17 "source-value" -242.67154 } }