{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45078e-10 0.0 0.0 ] "source-value" [ 5.45078 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.24172e-11 5.56718e-10 0.0 ] "source-value" [ 0.124172 5.56718 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.70044e-12 3.88551e-12 5.42613e-10 ] "source-value" [ -0.0770044 0.0388551 5.42613 ] } "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" [ [ -1.81969292536967e-10 4.420732140817843e-10 1.678781331352649e-09 ] [ -2.474920518170997e-09 -1.516682393484505e-09 -1.577775470865216e-10 ] [ 6.927274979171231e-10 -1.052440342153697e-09 -5.498644527759667e-10 ] [ 9.064461632425115e-10 4.631697145185063e-10 -6.053726628918931e-10 ] [ -6.507749837544614e-10 -9.616208001859873e-10 5.846496298254797e-10 ] [ 3.584525721066528e-10 5.713542875730951e-10 2.85786171905593e-10 ] [ -3.683935973857306e-10 6.807723764080379e-10 -2.813651257381574e-10 ] [ 1.718432158581869e-09 1.373373783025104e-09 -9.548373445911822e-10 ] ] "source-value" [ [ -0.11357630000000003 0.27592040000000007 1.0478129000000003 ] [ -1.5447239000000004 -0.9466387000000003 -0.09847700000000002 ] [ 0.4323665000000001 -0.6568816000000001 -0.34319840000000007 ] [ 0.5657592000000001 0.28908780000000006 -0.3778439000000001 ] [ -0.4061818000000001 -0.6001965000000001 0.36490960000000006 ] [ 0.22372850000000005 0.3566113000000001 0.17837370000000002 ] [ -0.22993320000000006 0.42490470000000014 -0.17561430000000003 ] [ 1.0725610000000003 0.8571925000000002 -0.5959626000000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.1219e-12 -9.108e-12 -1.41264e-11 ] [ 1.43794e-10 1.32483e-10 1.35293e-10 ] [ -7.165440000000001e-13 2.71531e-10 2.76218e-10 ] [ 1.33045e-10 4.09617e-10 4.06457e-10 ] [ 2.76499e-10 -4.09375e-12 2.74385e-10 ] [ 3.91349e-10 1.4388e-10 4.069950000000001e-10 ] [ 2.74821e-10 2.70058e-10 1.27143e-11 ] [ 4.06928e-10 4.06454e-10 1.39302e-10 ] ] "source-value" [ [ -0.041219 -0.09108 -0.141264 ] [ 1.43794 1.32483 1.35293 ] [ -0.00716544 2.71531 2.76218 ] [ 1.33045 4.09617 4.06457 ] [ 2.76499 -0.0409375 2.74385 ] [ 3.91349 1.4388 4.06995 ] [ 2.74821 2.70058 0.127143 ] [ 4.06928 4.06454 1.39302 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.016304209777526e-16 "source-value" 634.3272 } }