{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.08883e-09 0.0 0.0 ] "source-value" [ 10.8883 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -5.08893e-10 9.25118e-10 0.0 ] "source-value" [ -5.08893 9.25118 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.92429e-14 -1.06915e-12 1.00599e-09 ] "source-value" [ 0.000292429 -0.0106915 10.0599 ] } "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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5.5830217 ] [ 0.0677452 -1.0674311 -10.1604885 ] [ -7.8363232 5.1058292 -3.1635152 ] [ -0.6090378 3.9324105 0.5267987 ] [ -3.9471193 2.1234105 -0.5143414 ] [ 0.8927596 0.1476719 4.2769105 ] [ 3.3132226 -0.9763568 -8.1643789 ] [ 4.938642 -1.9106951 17.6768432 ] [ -0.6993123 0.5571204 3.0856972 ] [ -0.5723614 1.4528268 6.5921213 ] [ 4.0308546 -1.8676901 -13.5735891 ] [ -1.5697142 3.0045384 5.633847 ] [ 4.5015828 -2.7999715 8.4459776 ] [ -0.4465717 -4.2677221 -2.5338339 ] [ 0.9594748 2.7780181 -15.3825746 ] [ 5.0803472 3.2517528 9.6639188 ] [ 2.7891536 3.83084 2.3657388 ] [ 1.6671988 -1.0049147 -8.5636987 ] [ 10.0291918 -1.2361948 -1.4292381 ] [ 4.6729218 1.758935 8.520778 ] [ 5.9922947 -0.8460581 2.7360469 ] [ -0.4946642 2.3136858 -0.9482658 ] [ 3.0268903 6.4695141 -4.5628986 ] [ 3.5899438 -0.2414384 16.0550651 ] [ 3.7118049 -1.8637828 -3.6915632 ] [ -1.0472171 -1.3414131 -0.8701895 ] [ 1.4354813 2.3800215 -17.2655901 ] [ 5.660655 -3.346788 28.6686249 ] [ -0.1507413 2.3445229 0.1073588 ] [ -2.1210323 -0.6488389 -1.1831604 ] [ 0.7682435 6.1191707 -25.3020329 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.6554599999999999e-12 4.6381e-13 1.28623e-11 ] [ -2.3478800000000003e-12 -4.52155e-12 2.54548e-10 ] [ -4.887270000000001e-13 -4.624800000000001e-13 5.13702e-10 ] [ -4.47334e-12 -3.06647e-11 7.45196e-10 ] [ -1.2630600000000002e-10 2.3057500000000003e-10 3.6396800000000006e-11 ] [ -1.39208e-10 2.33654e-10 2.5263e-10 ] [ -1.1753700000000002e-10 2.25364e-10 4.907350000000001e-10 ] [ -1.46062e-10 2.40803e-10 7.6638e-10 ] [ -2.6570700000000003e-10 4.84171e-10 -1.7287800000000002e-11 ] [ -2.6952099999999997e-10 4.914010000000001e-10 2.7391100000000005e-10 ] [ -2.71562e-10 4.80584e-10 5.089260000000001e-10 ] [ -2.41811e-10 4.7596e-10 7.570710000000001e-10 ] [ -3.78692e-10 6.96269e-10 -1.2418400000000001e-11 ] [ -3.6736800000000003e-10 6.79821e-10 2.2855500000000002e-10 ] [ -3.63384e-10 6.77872e-10 5.17021e-10 ] 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