{ "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" [ [ -0.0641843 -1.6381691 -0.9587384 ] [ 0.8328308 2.3198072 0.6406823 ] [ 1.0502896 0.6361553 -0.8712594 ] [ -1.4849851 -0.7471342 -0.1886578 ] [ 1.5161459 0.7931142 0.422925 ] [ -2.0863249 -0.0538297 0.7281742 ] [ 0.0924443 -1.0886496 -0.9776508 ] [ 0.1437835 -0.2212941 1.2045251 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.028345857296462e-10 -2.624636254560809e-09 -1.536068262598545e-09 ] [ 1.334342047835527e-09 3.716740891224964e-09 1.026486210877378e-09 ] [ 1.682749456053206e-09 1.01923315725526e-09 -1.39591145283286e-09 ] [ -2.379208429058153e-09 -1.197040957702283e-09 -3.022631189818451e-10 ] [ 2.4291335347149e-09 1.270709039333603e-09 6.7760055293445e-10 ] [ -3.342661005712386e-09 -8.624468755522979e-11 1.166663688721643e-09 ] [ 1.481120974064862e-10 -1.744208951733446e-09 -1.566369267971407e-09 ] [ 2.30366564054739e-10 -3.545522362620594e-10 1.929861970286513e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.606502 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.224137562087426e-18 } }