{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.474350000000001e-10 0.0 0.0 ] "source-value" [ 5.47435 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.16605e-11 5.34737e-10 0.0 ] "source-value" [ -0.716605 5.34737 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.76149e-11 -1.65536e-11 5.698150000000001e-10 ] "source-value" [ -0.276149 -0.165536 5.69815 ] } "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" [ [ -1.059568746374961e-09 -1.59377368507689e-09 -4.744773964551264e-10 ] [ 4.189238447408313e-10 -1.804515506240832e-11 1.772492802120902e-09 ] [ -7.903745553367105e-11 -4.509534382202304e-10 -1.782756345553747e-10 ] [ -1.290418364782929e-09 -2.765588362022505e-09 1.365757836458131e-09 ] [ 7.588523711931187e-10 1.946681924987265e-09 -2.185303541965071e-09 ] [ 7.260412359580935e-10 1.488768791743941e-09 5.610143203154382e-10 ] [ 1.03156990883817e-09 1.583827372614964e-09 -5.222078401653792e-10 ] [ -5.063627940386534e-10 -1.90917448964135e-10 -3.390003855358579e-10 ] ] "source-value" [ [ -0.6613308 -0.9947553 -0.2961455 ] [ 0.2614717 -0.0112629 1.106303 ] [ -0.0493313 -0.281463 -0.1112709 ] [ -0.8054158 -1.7261445 0.852439 ] [ 0.4736384 1.2150233 -1.3639592 ] [ 0.4531593 0.9292164 0.3501576 ] [ 0.6438553 0.9885473 -0.3259365 ] [ -0.3160468 -0.1191613 -0.2115874 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.69074e-11 4.07786e-12 -1.11283e-11 ] [ 1.40941e-10 1.27172e-10 1.01322e-10 ] [ -3.06599e-11 2.71071e-10 2.41068e-10 ] [ 1.07784e-10 4.29368e-10 3.98414e-10 ] [ 2.55814e-10 1.58673e-11 3.18004e-10 ] [ 3.994e-10 1.24784e-10 4.28471e-10 ] [ 2.16355e-10 2.62993e-10 -1.60126e-11 ] [ 3.70597e-10 4.39593e-10 1.80666e-10 ] ] "source-value" [ [ 0.269074 0.0407786 -0.111283 ] [ 1.40941 1.27172 1.01322 ] [ -0.306599 2.71071 2.41068 ] [ 1.07784 4.29368 3.98414 ] [ 2.55814 0.158673 3.18004 ] [ 3.994 1.24784 4.28471 ] [ 2.16355 2.62993 -0.160126 ] [ 3.70597 4.39593 1.80666 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.793322159208773e-18 "source-value" 29.917564 } }