{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0745901 -0.1592746 -2.1295982 ] [ 1.7507316 0.6014628 1.7106462 ] [ 0.4148834 0.662574 -1.0985767 ] [ -0.8551462 -0.8884666 0.1960969 ] [ 0.0016684 1.7443045 -0.8578238 ] [ -0.442738 -0.9580513 1.9788379 ] [ -0.2259428 -0.5033351 -1.3304892 ] [ 0.4311338 -0.4992138 1.530907 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.721683135163134e-09 -2.551860404072716e-10 -3.411992447737763e-09 ] [ 2.804981238815777e-09 9.636496364409062e-10 2.740757348100361e-09 ] [ 6.647164838380147e-10 1.061560572349939e-09 -1.760113904895615e-09 ] [ -1.370095249005961e-09 -1.423480414881665e-09 3.141818685913555e-10 ] [ 2.67307147414272e-12 2.794683889456234e-09 -1.374385237125815e-09 ] [ -7.093444727397504e-10 -1.534967394387047e-09 3.170447819732968e-09 ] [ -3.620002717980903e-10 -8.064317296480301e-10 -2.131678690466895e-09 ] [ 6.90752494796663e-10 -7.99828679140727e-10 2.452783404019066e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.924698 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.313812165770052e-18 } }