{ "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" [ 5.44976 0 0 ] "si-unit" "m" "si-value" [ 5.449760000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0355309 5.38277 0 ] "si-unit" "m" "si-value" [ -3.55309e-12 5.38277e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.05055 0.148675 5.46244 ] "si-unit" "m" "si-value" [ 5.055e-12 1.48675e-11 5.46244e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0326933 -0.0289977 0.141129 ] [ 1.38935 1.3881 1.19735 ] [ 0.0127821 2.83796 2.59214 ] [ 1.40644 4.238 3.96398 ] [ 2.76811 0.0511022 2.83036 ] [ 4.1335 1.52222 4.23862 ] [ 2.69114 2.71897 0.000278438 ] [ 4.17588 4.12802 1.32379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.26933e-12 -2.89977e-12 1.41129e-11 ] [ 1.38935e-10 1.3881e-10 1.19735e-10 ] [ 1.27821e-12 2.83796e-10 2.59214e-10 ] [ 1.40644e-10 4.238000000000001e-10 3.96398e-10 ] [ 2.76811e-10 5.11022e-12 2.830360000000001e-10 ] [ 4.1335e-10 1.52222e-10 4.23862e-10 ] [ 2.69114e-10 2.71897e-10 2.78438e-14 ] [ 4.17588e-10 4.12802e-10 1.32379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8119109 0.7257311 -3.1555002 ] [ 0.1466841 -0.2294432 3.1478005 ] [ 0.7959617 -1.1910678 1.275223 ] [ -1.6312483 -1.6155732 2.1933688 ] [ 1.5431499 2.1599942 -2.2995453 ] [ 0.4384434 -0.6119474 -1.4887484 ] [ 0.7004762 1.4705606 -0.8423096 ] [ -2.8053779 -0.7082543 1.1697111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.300824672869911e-09 1.162749410987117e-09 -5.055668689022326e-09 ] [ 2.350138375993194e-10 -3.676085338701888e-10 5.043332409593516e-09 ] [ 1.275271237298918e-09 -1.908300998669785e-09 2.043132493739382e-09 ] [ -2.613547910512222e-09 -2.588433631556608e-09 3.514164241104619e-09 ] [ 2.472398712539436e-09 3.460692236815522e-09 -3.68427774848452e-09 ] [ 7.024637708115155e-10 -9.804478255170516e-10 -2.385237900384885e-09 ] [ 1.122286600313111e-09 2.35609783220102e-09 -1.349528759713886e-09 ] [ -4.494710920919988e-09 -1.134748490390026e-09 1.874083792950437e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.355213292303475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.504311999301483e-18 } }