{ "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" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5740719 -0.9251176 4.6984568 ] [ -2.5699439 5.733289 -6.2060617 ] [ -0.7692714 0.9312612 1.8349561 ] [ -11.7577485 6.6062915 -12.6910875 ] [ 2.6472727 -5.2313838 3.9682643 ] [ -1.0600616 2.2588459 -1.9564448 ] [ 9.3100024 -12.1839641 10.0437401 ] [ 4.7738222 2.8107778 0.3081767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.197645768382356e-10 -1.482201790210606e-09 7.527757638798781e-09 ] [ -4.117504033347573e-09 9.18574159608981e-09 -9.943206962982303e-09 ] [ -1.232508652130085e-09 1.492044922498153e-09 2.939923763614347e-09 ] [ -1.883798975994627e-08 1.058444579148976e-08 -2.033336368502712e-08 ] [ 4.241398428822092e-09 -8.381600818791863e-09 6.357860286615277e-09 ] [ -1.698405912127841e-09 3.619070090969935e-09 -3.134570118445732e-09 ] [ 1.491626818487189e-08 -1.952086242968652e-08 1.609184557361146e-08 ] [ 7.648506320696022e-09 4.503362477423658e-09 4.937535038152955e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -28.543621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.573192223917592e-18 } }