{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4039456 1.4402693 0.5637602 ] [ -4.0886565 -2.634537 1.767785 ] [ 0.3431325 -0.5114978 -0.3565548 ] [ 1.394959 -0.6087568 -0.0824219 ] [ 2.4420863 -0.5709026 0.2705015 ] [ -1.4140607 0.0928188 -0.8243119 ] [ 1.4888026 2.8067415 -3.4264692 ] [ -1.5702087 -0.0141354 2.0877109 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.24936883572711e-09 2.307565819127536e-09 9.032434196191668e-10 ] [ -6.550749908752221e-09 -4.220993622808457e-09 2.83230382093569e-09 ] [ 5.497588738660049e-10 -8.195098235024052e-10 -5.712637693005432e-10 ] [ 2.234970715188006e-09 -9.75335920748611e-10 -1.320544423098846e-10 ] [ 3.912653608071514e-09 -9.146868060098484e-10 4.33391182761951e-10 ] [ -2.265575012597684e-09 1.487121125559192e-10 -1.320693265308145e-09 ] [ 2.385324738358448e-09 4.49689564897811e-09 -5.489808889360672e-09 ] [ -2.515751689643515e-09 -2.26474075922436e-11 3.34488162252711e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.784467 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.733303688754407e-18 } }