{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7911415 1.7953201 -0.7724635 ] [ 0.9666009 -1.3679517 -0.6004012 ] [ 3.2530056 0.1385895 0.7716873 ] [ 0.063731 -0.7382973 1.3637715 ] [ -0.0459156 0.8587396 -1.5363875 ] [ -1.7103039 -1.0822656 1.9089925 ] [ -0.7909322 -0.6710942 -0.3175165 ] [ -3.5273275 1.0669596 -0.8176826 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.869725035844643e-09 2.876419891072318e-09 -1.237622960121341e-09 ] [ 1.548665363624239e-09 -2.191700232123616e-09 -9.61948765740265e-10 ] [ 5.211889519651476e-09 2.220448567883616e-10 1.236379350628276e-09 ] [ 1.021083182202048e-10 -1.182882673259764e-09 2.185002813413347e-09 ] [ -7.356490085000449e-11 1.375852510475144e-09 -2.46156413298936e-09 ] [ -2.740208923043061e-09 -1.733980641816085e-09 3.058543152782544e-09 ] [ -1.26721307947791e-09 -1.075211437594479e-09 -5.087175130182431e-10 ] [ -5.651401654404912e-09 1.70945772645812e-09 -1.310071944954958e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.431898 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.234856901897028e-18 } }