{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.47435 0 0 ] "si-unit" "m" "si-value" [ 5.474350000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.716605 5.34737 0 ] "si-unit" "m" "si-value" [ -7.16605e-11 5.34737e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.276149 -0.165536 5.69815 ] "si-unit" "m" "si-value" [ -2.76149e-11 -1.65536e-11 5.698150000000001e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3868998 -2.8535362 -2.1541147 ] [ -1.255423 -0.7300522 6.6493155 ] [ 1.0430815 -0.8345385 1.9086186 ] [ -10.5845533 -13.6906257 8.1458946 ] [ 6.8924296 10.2964558 -10.8603468 ] [ 1.6919742 3.4534302 1.219364 ] [ 5.8542709 4.8199532 -2.8861642 ] [ -1.2548801 -0.4610867 -2.022567 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.824235055752196e-09 -4.571868986246473e-09 -3.451272210861606e-09 ] [ -2.011409379814598e-09 -1.169672566803606e-09 1.065337783842306e-08 ] [ 1.671200792888995e-09 -1.337078073857501e-09 3.057944098944027e-09 ] [ -1.695832383887149e-08 -2.193480042066364e-08 1.305116188362097e-08 ] [ 1.10428895656299e-08 1.649674075986056e-08 -1.740019373674009e-08 ] [ 2.710841506236784e-09 5.533005128004669e-09 1.953636493045171e-09 ] [ 9.379575967809774e-09 7.722416330390146e-09 -4.624144805029936e-09 ] [ -2.010539558127166e-09 -7.387423309018233e-10 -3.240509561401594e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.982215 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.240197797999907e-18 } }