{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46856e-10 0.0 0.0 ] "source-value" [ 5.46856 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] "source-value" [ 0.109414 5.47364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] "source-value" [ 0.0853482 0.188746 5.50226 ] } "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" [ [ -1.703276689272735e-09 -1.562682005791308e-09 -8.987964107488398e-10 ] [ -1.324182955324992e-11 -1.495031059284e-10 2.482291652150312e-09 ] [ 1.531332536287438e-09 -1.158248246408991e-09 -4.977695197329927e-10 ] [ -1.116165315069397e-09 3.214757776575476e-10 -8.931128494042137e-10 ] [ -4.890828385303393e-10 -3.78279828224377e-10 -2.118683435895586e-09 ] [ 5.861641673851219e-10 1.137415304026391e-09 1.153173191744945e-09 ] [ -1.349828996494138e-10 -1.474123295253208e-09 -1.565618635319572e-09 ] [ 1.339252868402575e-09 3.263945399922346e-09 2.338516007205947e-09 ] ] "source-value" [ [ -1.0631017 -0.9753494 -0.5609846 ] [ -0.0082649 -0.0933125 1.5493246 ] [ 0.9557826 -0.7229217 -0.3106833 ] [ -0.6966556 0.2006494 -0.5574372 ] [ -0.3052615 -0.2361037 -1.3223782 ] [ 0.3658549 0.7099188 0.7197541 ] [ -0.0842497 -0.9200754 -0.9771823 ] [ 0.8358959 2.0371945 1.4595869 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.321303623213588e-18 "source-value" -26.971456 } }