{ "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" [ 5.5612 0 0 ] "si-unit" "m" "si-value" [ 5.5612e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0917257 5.43287 0 ] "si-unit" "m" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0143429 0.0662566 5.45634 ] "si-unit" "m" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5437718999999999 -0.12969729999999996 0.22169319999999998 ] [ 4.854911199999999 5.250072599999999 -6.564201899999999 ] [ -7.161207599999999 4.625107799999999 -5.7863128999999995 ] [ 0.34343049999999997 1.9965910999999998 0.22087199999999999 ] [ 0.17342819999999998 0.19753569999999998 1.8713013999999997 ] [ -0.7678148999999999 -0.33417389999999997 -0.26552869999999995 ] [ -2.5432569999999997 -6.310482199999999 6.271170499999999 ] [ 5.644281499999999 -5.2949535999999995 4.031006499999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.712186324057842e-10 -2.077979835528881e-10 3.551916649566887e-10 ] [ 7.7784252847849e-09 8.411543646523627e-09 -1.05170109050384e-08 ] [ -1.147351948794322e-08 7.410239646891144e-09 -9.270695325392777e-09 ] [ 5.502363225029369e-10 3.198891608072357e-09 3.53875957504848e-10 ] [ 2.778626097166788e-10 3.164870829208337e-10 2.998155378251487e-09 ] [ -1.230175092017046e-09 -5.354056142726526e-10 -4.254238787963957e-10 ] [ -4.074746939656937e-09 -1.011050713011291e-08 1.004752284293009e-08 ] [ 9.043135935018469e-09 -8.48345093603418e-09 6.458384425802119e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.890624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.590094251847961e-18 } }