{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2094206 5.4233041 -1.2504656 ] [ 0.0012028 1.4146227 -5.4962176 ] [ -0.8144155 0.2582768 4.0789487 ] [ -0.3272136 1.2561897 -4.5047747 ] [ 5.1939675 -7.2101459 1.6954344 ] [ 2.287489 -2.5165349 -2.4922999 ] [ -1.5062527 -2.1297332 4.4017892 ] [ -4.6253569 3.5040207 3.5675855 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.355287919982604e-10 8.6890911080964e-09 -2.00346676594079e-09 ] [ 1.9270980553752e-12 2.266475435865991e-09 -8.805911414099556e-09 ] [ -1.304837484467427e-09 4.138050540642912e-10 6.535196298424675e-09 ] [ -5.242539842470223e-10 2.012637785211469e-09 -7.217444765774358e-09 ] [ 8.321653366255394e-09 -1.15519272887109e-08 2.716385380159809e-09 ] [ 3.664961426332025e-09 -4.031933415425526e-09 -3.993104664700536e-09 ] [ -2.413282880839412e-09 -3.412208769694048e-09 7.052443804033551e-09 ] [ -7.410638749090674e-09 5.614060090592323e-09 5.715902127897206e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.299428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.014721219916534e-18 } }