{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45804e-10 0.0 0.0 ] "source-value" [ 5.45804 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] "source-value" [ -0.0357167 5.39587 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] "source-value" [ 0.019829 -0.0610013 5.23355 ] } "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" [ [ -6.487171160591735e-09 7.150038892827009e-09 5.100019139280737e-09 ] [ -1.031773193007817e-08 -7.478071418087519e-09 8.398702612259944e-09 ] [ -4.353049310995782e-09 -1.03219565493919e-08 -5.571353225423517e-09 ] [ 9.199581357957945e-09 -2.575396378632269e-09 4.910456330649489e-09 ] [ 6.84682168015776e-10 2.078884887981928e-09 -4.152930241263068e-09 ] [ 3.070109105590437e-09 1.593357920243793e-09 1.238042409960666e-09 ] [ 7.085294935580481e-09 8.047539943777931e-09 -8.823347509278328e-09 ] [ 1.118284834521053e-09 1.505602701281025e-09 -1.099589516185924e-09 ] ] "source-value" [ [ -4.0489738 4.4627033 3.1831816 ] [ -6.4398218 -4.6674451 5.2420579 ] [ -2.7169597 -6.4424586 -3.4773652 ] [ 5.7419271 -1.607436 3.0648658 ] [ 0.427345 1.2975379 -2.5920552 ] [ 1.9162114 0.9944958 0.7727253 ] [ 4.4222933 5.0228794 -5.5071004 ] [ 0.6979785 0.9397233 -0.6863098 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.028670089034742e-18 "source-value" -18.903472 } }