{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.1346012 18.726461 -2.1273562 ] [ -18.1141162 18.2481145 -37.1540019 ] [ -6.5968853 6.1930831 11.2889308 ] [ -3.6373496 4.0597811 -16.7050865 ] [ 28.4512297 -29.7182358 28.5040482 ] [ 8.5257346 -8.167653 -8.7939596 ] [ -2.1711282 -4.113571 15.846414 ] [ -12.5920862 -5.2279799 9.1410112 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.828714620571624e-09 3.000309800452299e-08 -3.408400367753929e-09 ] [ -2.902201348209454e-08 2.923670242558148e-08 -5.952727321333877e-08 ] [ -1.056937539775919e-08 9.922412953491588e-09 1.808686100158904e-08 ] [ -5.827676490796232e-09 6.504486363985708e-09 -2.67644990387417e-08 ] [ 4.55838950583506e-08 -4.761386261018158e-08 4.566851962419633e-08 ] [ 1.365973265126564e-08 -1.308602268340698e-08 -1.408947647537972e-08 ] [ -3.478530842799587e-09 -6.590667284200878e-09 2.538875403431781e-08 ] [ -2.017474611673831e-08 -8.376147169792323e-09 1.464551443511095e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -18.728516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.000639047747873e-18 } }