{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2933602 -8.0582307 -3.9690288 ] [ 10.7132939 2.8223379 1.4010361 ] [ 9.2896735 -14.2322316 14.6152755 ] [ -43.1478369 36.8071618 -28.5173461 ] [ -13.5463627 -12.3456223 -10.9768642 ] [ 29.3335998 -8.6710653 -15.0018291 ] [ 24.2173697 -14.1289941 56.303785 ] [ -10.566377 17.8066444 -13.8550284 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.008307457871321e-08 -1.291070883255282e-08 -6.359085150641879e-09 ] [ 1.716458901833925e-08 4.521883799377768e-09 2.244707284316811e-09 ] [ 1.488369769656531e-08 -2.280254873133098e-08 2.341625271265103e-08 ] [ -6.913045551927156e-08 5.897157411396285e-08 -4.568982520868206e-08 ] [ -2.170366561481716e-08 -1.977986741828713e-08 -1.758687519093649e-08 ] [ 4.699760780346356e-08 -1.389257810109014e-08 -2.40355798532571e-08 ] [ 3.880050355061031e-08 -2.263714402244114e-08 9.020860798954972e-08 ] [ -1.692920219595884e-08 2.852938935257925e-08 -2.219820258300003e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1807465 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.300470920591427e-19 } }