{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.07511e-09 0.0 0.0 ] "source-value" [ 10.7511 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -5.546640000000001e-10 8.989990000000001e-10 0.0 ] "source-value" [ -5.54664 8.98999 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.88053e-11 -1.17226e-11 1.00731e-09 ] "source-value" [ -0.388053 -0.117226 10.0731 ] } "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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1.1253854 ] [ -0.7180802 -2.9678998 -0.3270298 ] [ -3.1264135 -4.0150767 -0.2563839 ] [ 0.3992524 -0.9845486 -1.4661868 ] [ 0.2937225 0.8162476 1.0897992 ] [ 0.0124824 1.7835339 -1.3337185 ] [ -1.4092473 -1.838674 1.5386794 ] [ -0.1743931 -0.0660117 -1.1289274 ] [ -0.8373443 0.7968035 1.6681519 ] [ 0.6515647 1.4396249 0.4014904 ] [ 0.0537897 1.1219057 0.4581338 ] [ -3.8394318 0.147117 -2.5600134 ] [ -1.5069851 0.8290396 -2.9492516 ] [ -0.2789125 -0.391715 2.7887314 ] [ -0.3593159 0.1867381 -1.0325292 ] [ -1.3964961 -0.6866791 -0.303102 ] [ -3.1398044 -0.4170332 -0.1271598 ] [ 0.3736205 1.0509109 0.3250042 ] [ 3.0962095 -1.5814282 -0.5567584 ] [ -0.9901851 -3.3006324 0.5567125 ] [ -0.557111 -1.3968754 3.5103222 ] [ 0.9068993 1.7915675 -0.0297846 ] [ 1.686635 4.6569248 -0.076736 ] [ -2.2759341 -2.2599837 -2.8683846 ] [ 1.3658534 -0.5938596 2.2510583 ] [ -0.4882609 -1.1693992 -0.4058051 ] [ 0.8608504 2.380335 -1.1318415 ] [ 2.8434378 -0.0544823 0.1519353 ] [ -1.8018739 -0.1717489 2.7735399 ] [ 1.0162122 1.5173106 0.3091244 ] [ -0.0465228 -0.8579938 -1.0301637 ] [ -0.0377909 1.3103855 -2.2581462 ] [ 1.1768636 0.6823727 2.5582923 ] [ 0.2046894 -0.4484458 1.1024192 ] [ 0.3271743 -1.1477656 -0.002147 ] [ 1.7041126 0.2295534 -3.1335468 ] [ 0.2705345 0.654463 3.4483846 ] [ -1.2322373 0.0983615 -0.3155669 ] [ -0.1793888 0.9054933 -3.0605808 ] [ 2.8081289 -0.3464279 0.6307511 ] [ 0.9687793 0.4155285 3.8403493 ] [ 0.8456838 0.5162579 0.0386174 ] [ 0.1938791 0.9554855 -0.2556466 ] [ 0.637103 3.7269249 -3.3336921 ] [ -1.8985617 0.21648050000000002 11.1954684 ] [ 0.1453853 -0.5633916 1.5429202 ] [ -0.8199463 -0.3935162 -0.405361 ] [ 3.6695611 0.5444398 -11.9211994 ] [ -0.9564353 -0.9512899 0.0900592 ] [ -0.0291706 -0.2523984 -2.6123724 ] [ -0.4873364 -0.2593845 2.1877619 ] [ -0.8539385 -0.1082719 0.1481534 ] [ 0.0472642 -0.10715380000000001 -4.237073 ] [ 0.5576517 -1.1070884 4.0648469 ] [ -1.0927017 -0.2379678 -0.3111345 ] [ 0.1327915 -0.7624675 0.4679938 ] [ 0.2623908 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5.4027 ] [ 6.34526 2.49106 7.77065 ] [ 5.37638 4.73646 0.51975 ] [ 5.05673 4.72759 2.60401 ] [ 5.04362 4.68387 5.39048 ] [ 4.72881 4.77988 7.83039 ] [ 3.77924 6.93132 0.307909 ] [ 3.81833 6.81599 3.16615 ] [ 3.60385 6.97139 5.46765 ] [ 3.59881 6.9444 7.90601 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.78896666223385e-17 "source-value" -236.4887 } }