{ "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" [ [ 6.4518779 22.1480969 -3.1221222 ] [ -29.4410011 28.2223043 -47.6899969 ] [ -5.8975021 5.1012085 10.8959676 ] [ -1.9112394 6.9897455 -19.0200923 ] [ 43.9579594 -46.446091 43.4877041 ] [ 5.6397201 -10.1014292 -13.5141924 ] [ -3.3636942 -3.6266329 17.7046141 ] [ -15.4361207 -2.2872022 11.2581181 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.033704801680099e-08 3.548516334074783e-08 -5.002191237332675e-09 ] [ -4.716968404398829e-08 4.521711650709772e-08 -7.640779870871241e-08 ] [ -9.44884006358593e-09 8.173037063862188e-09 1.745726469354106e-08 ] [ -3.062143108660179e-09 1.119880691770664e-08 -3.047354745958332e-08 ] [ 7.042841542900066e-08 -7.441484174083769e-08 6.9674983375326e-08 ] [ 9.035827766520141e-09 -1.618427383424531e-08 -2.165212329066038e-08 ] [ -5.389232251161322e-09 -5.810506492475658e-09 2.836591902500694e-08 ] [ -2.473139190514372e-08 -3.664501922073394e-09 1.803749376263248e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.413127 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.789890520427452e-18 } }