{ "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" [ [ 1.7777952 2.044778 -1.1870979 ] [ 1.3081357 -1.517305 -0.849092 ] [ 3.5264888 -0.356113 1.0512274 ] [ 0.1019456 -0.6523545 1.4471181 ] [ -0.1076138 0.8415606 -1.5715264 ] [ -1.8259658 -1.5014446 2.5799354 ] [ -0.952612 -0.693827 -0.488591 ] [ -3.8281737 1.8347055 -0.9819736 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.84834190601046e-09 3.276095506326182e-09 -1.901940501980776e-09 ] [ 2.095864435373842e-09 -2.430990597622944e-09 -1.360395351308313e-09 ] [ 5.650057908873047e-09 -5.705559229629505e-10 1.68425196342437e-09 ] [ 1.633348569134285e-10 -1.045187128373674e-09 2.318538787356516e-09 ] [ -1.72416314435447e-10 1.34832871830642e-09 -2.517862857049989e-09 ] [ -2.925519715140369e-09 -2.405579435546408e-09 4.133512181054297e-09 ] [ -1.52625267509353e-09 -1.111633398279801e-09 -7.828090773332928e-10 ] [ -6.133410402501433e-09 2.939522258153175e-09 -1.573295144162811e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.334147 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.661154423931046e-18 } }