{ "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" [ 5.41394 0 0 ] "si-unit" "m" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0321649 5.43167 0 ] "si-unit" "m" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.034689 -0.0250046 5.52467 ] "si-unit" "m" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0104706 0.0216981 0.0176006 ] [ 1.39448 1.38403 1.49781 ] [ 0.0179868 2.6904 2.7801 ] [ 1.33759 4.02716 4.17727 ] [ 2.6683 -0.0231463 2.83015 ] [ 4.02805 1.42643 4.22871 ] [ 2.71964 2.8128 -0.0574889 ] [ 4.09713 4.0529 1.34951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04706e-12 2.16981e-12 1.76006e-12 ] [ 1.39448e-10 1.38403e-10 1.49781e-10 ] [ 1.79868e-12 2.6904e-10 2.7801e-10 ] [ 1.33759e-10 4.02716e-10 4.17727e-10 ] [ 2.6683e-10 -2.31463e-12 2.83015e-10 ] [ 4.02805e-10 1.42643e-10 4.228710000000001e-10 ] [ 2.71964e-10 2.8128e-10 -5.74889e-12 ] [ 4.09713e-10 4.052900000000001e-10 1.34951e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3157035 0.2645489 0.5039017 ] [ -0.1752879 -0.2579227 -1.4959031 ] [ -0.606557 0.3635462 0.2409416 ] [ -0.5019834 1.232979 -0.5886052 ] [ 0.7430652 0.0468506 -0.174872 ] [ 0.3583917 -1.0607049 -1.1097898 ] [ 0.0311094 -1.2612322 1.8596996 ] [ -0.1644414 0.6719351 0.7646273 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.058127668047329e-10 4.238540626383571e-10 8.073395229213753e-10 ] [ -2.808421752891283e-10 -4.132377199136121e-10 -2.396700973802245e-09 ] [ -9.718114445825857e-10 5.824652222206809e-10 3.860309984981453e-10 ] [ -8.042660675096947e-10 1.975450127737363e-09 -9.430494903213083e-10 ] [ 1.190521691170076e-09 7.506293599045247e-11 -2.801758300325376e-10 ] [ 5.742068028287674e-10 -1.699436592348002e-09 -1.778079271562308e-09 ] [ 4.984275336711552e-11 -2.02071674424015e-09 2.979567220831111e-09 ] [ -2.634641665716211e-10 1.07655870791491e-09 1.225067983685428e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.41802 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.834810021982682e-18 } }