{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44038e-10 0.0 0.0 ] "source-value" [ 5.44038 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] "source-value" [ 0.0177809 5.34742 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] "source-value" [ 0.258508 -0.216411 5.45927 ] } "species" { "source-value" [ "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" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.010409801989603e-09 8.893648776351764e-10 6.457274865282932e-10 ] [ 3.3257181206256e-11 -1.619409632533325e-10 -1.224261608192179e-10 ] [ -1.309909163810285e-10 2.539808831531059e-10 -3.181889123199763e-10 ] [ 4.708191465768538e-10 -5.07114855744457e-10 -2.952713779360532e-10 ] [ 1.026838200623962e-10 1.25338277045184e-12 -4.478650825659763e-10 ] [ 4.743154163987635e-10 -1.16704627888679e-10 1.029433726749657e-10 ] [ 3.011883764143296e-11 3.83488985071584e-11 3.437011717412851e-10 ] [ 3.020631648492864e-11 -3.971875951794239e-10 9.137966291434177e-11 ] ] "source-value" [ [ -0.6306482 0.5550979 0.4030314 ] [ 0.0207575 -0.1010756 -0.0764124 ] [ -0.0817581 0.1585224 -0.1985979 ] [ 0.2938622 -0.3165162 -0.1842939 ] [ 0.0640902 0.0007823 -0.2795354 ] [ 0.2960444 -0.0728413 0.0642522 ] [ 0.0187987 0.0239355 0.2145214 ] [ 0.0188533 -0.247905 0.0570347 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.981458069341538e-18 "source-value" 31.091816 } }