{ "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" [ 5.44141 0 0 ] "si-unit" "m" "si-value" [ 5.441410000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0387259 5.36248 0 ] "si-unit" "m" "si-value" [ 3.87259e-12 5.36248e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.184794 -0.00314768 5.51994 ] "si-unit" "m" "si-value" [ -1.84794e-11 -3.14768e-13 5.51994e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.139299 -0.0133288 0.0135909 ] [ 1.42253 1.35934 1.29237 ] [ 0.0199653 2.64656 2.62294 ] [ 1.43068 4.14401 3.95964 ] [ 2.73386 -0.0804287 2.7169 ] [ 4.04879 1.39288 4.20461 ] [ 2.82765 2.77065 0.103593 ] [ 4.1636 4.04392 1.34337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.39299e-11 -1.33288e-12 1.35909e-12 ] [ 1.42253e-10 1.35934e-10 1.29237e-10 ] [ 1.99653e-12 2.64656e-10 2.62294e-10 ] [ 1.43068e-10 4.14401e-10 3.95964e-10 ] [ 2.73386e-10 -8.042870000000001e-12 2.7169e-10 ] [ 4.04879e-10 1.39288e-10 4.20461e-10 ] [ 2.827650000000001e-10 2.77065e-10 1.03593e-11 ] [ 4.1636e-10 4.04392e-10 1.34337e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 8.757627 -3.2774205 -5.022530299999999 ] [ -0.2629479 -0.9934814 0.24521579999999998 ] [ 0.2386251 0.3324005 1.7200485999999997 ] [ -7.5342407 1.0723738 7.191978299999999 ] [ 1.4208714 2.9537824 -1.0283745999999998 ] [ -1.326716 0.8504274 -1.9617540999999998 ] [ -0.8058632 -0.6869255 -2.4779180999999997 ] [ -0.4873558 -0.2511568 1.3333342999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.403126534868752e-08 -5.251006544892597e-09 -8.046980690217007e-09 ] [ -4.212889813393686e-10 -1.591732685393607e-09 3.928790250476172e-10 ] [ 3.823195595059134e-10 5.325643142299169e-10 2.755821676264412e-09 ] [ -1.20711844044718e-08 1.718132245273789e-09 1.152281958449504e-08 ] [ 2.276486956998867e-09 4.732481143200441e-09 -1.647637755119096e-09 ] [ -2.125633375153944e-09 1.362534909193371e-09 -3.143076580673699e-09 ] [ -1.291135189240469e-09 -1.100575985398767e-09 -3.970062480785674e-09 ] [ -7.808300752043771e-10 -4.023975564302112e-10 2.136237060770746e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.04153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.614272058561002e-18 } }