{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46438e-10 0.0 0.0 ] "source-value" [ 5.46438 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] "source-value" [ 0.0372754 5.43203 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] "source-value" [ 0.17857 -0.0223871 5.50346 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.682875052836454e-09 -1.515670298513145e-10 -3.297901450570595e-09 ] [ 2.659741204440002e-09 8.865500135300928e-10 2.67059883496384e-09 ] [ 6.319878606989607e-10 1.068858647075345e-09 -1.648369776042595e-09 ] [ -1.260363614206328e-09 -1.37649386177645e-09 3.565067286006912e-10 ] [ -1.9178054150976e-11 2.660880031582066e-09 -1.336164512748321e-09 ] [ -6.803397887204217e-10 -1.471600347728435e-09 2.960260992550472e-09 ] [ -3.278442695075654e-10 -8.221691095058381e-10 -2.02058200118634e-09 ] [ 6.788717142827828e-10 -7.944583433254675e-10 2.315651344650511e-09 ] ] "source-value" [ [ -1.050368 -0.0946007 -2.0583882 ] [ 1.6600799 0.553341 1.6668567 ] [ 0.3944558 0.6671291 -1.0288315 ] [ -0.7866571 -0.8591399 0.222514 ] [ -0.01197 1.6607907 -0.8339683 ] [ -0.4246347 -0.9185007 1.8476496 ] [ -0.2046243 -0.5131576 -1.2611481 ] [ 0.4237184 -0.4958619 1.4453159 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.530024158521451e-18 "source-value" -22.032678 } }