{ "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" [ [ -1.8639024 -2.1509329 -2.1455136 ] [ -1.1065772 -0.7769144 7.0997996 ] [ 1.1715018 -0.716687 2.0167832 ] [ -10.2016504 -13.6438442 8.9199527 ] [ 7.479952 10.9367017 -11.6934507 ] [ 0.7589082 2.4432547 0.9995651 ] [ 4.645702 3.9784584 -3.5321701 ] [ -0.883934 -0.0700361 -1.6649662 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.98630084873301e-09 -3.446174405289544e-09 -3.437491729528443e-09 ] [ -1.772932118950326e-09 -1.24475408804286e-09 1.137513293148519e-08 ] [ 1.876952795185117e-09 -1.14825915583129e-09 3.231242892262211e-09 ] [ -1.634484576445497e-08 -2.185984819507768e-08 1.429133967458183e-08 ] [ 1.19842042191062e-08 1.752252777240362e-08 -1.873497332801739e-08 ] [ 1.215904975373411e-09 3.914525558999718e-09 1.601479834187614e-09 ] [ 7.443235131603802e-09 6.374193035305375e-09 -5.659160354908799e-09 ] [ -1.416218389130227e-09 -1.122102020320109e-10 -2.667569920062217e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.044045 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.570539380206314e-18 } }