{ "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" [ [ -1.560386887782011e-09 -1.431483607537885e-09 -7.815869370069465e-10 ] [ -4.855636575827519e-11 -1.097617557201043e-10 2.405741095167446e-09 ] [ 1.452317991879444e-09 -1.006025445666783e-09 -4.082123327248109e-10 ] [ -1.105679549739247e-09 2.720326071396595e-10 -8.641924398751392e-10 ] [ -4.22732378786135e-10 -3.872316696577728e-10 -2.031046778002758e-09 ] [ 5.355184030956614e-10 1.00328764625716e-09 1.051986765952349e-09 ] [ -9.23438528047392e-11 -1.430728021043516e-09 -1.48911614363533e-09 ] [ 1.24186247967764e-09 3.089910246229242e-09 2.11642677012519e-09 ] ] "source-value" [ [ -0.9739169 -0.8934618 -0.4878282 ] [ -0.0303065 -0.0685079 1.5015455 ] [ 0.9064656 -0.6279117 -0.2547861 ] [ -0.6901109 0.1697894 -0.5393865 ] [ -0.2638488 -0.241691 -1.2676797 ] [ 0.3342443 0.6262029 0.6565985 ] [ -0.0576365 -0.8929902 -0.9294332 ] [ 0.7751096 1.9285703 1.3209697 ] ] } "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" -3.737157877935351e-18 "source-value" -23.325505 } }