{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.37157e-10 0.0 0.0 ] "source-value" [ 5.37157 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] "source-value" [ -0.00742946 5.44743 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] "source-value" [ 0.0324182 0.1292 5.41398 ] } "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" [ [ 2.970447150852532e-09 2.936779171560703e-09 1.166680662181924e-09 ] [ -7.224999609949054e-09 -4.506337078537835e-09 2.611244760087345e-09 ] [ 8.174067997181722e-10 -7.230123210564711e-10 -7.781701351454285e-10 ] [ 2.434073025223702e-09 -1.429210599565956e-09 2.109981694232698e-10 ] [ 5.068578666144806e-09 -9.936960556990792e-10 1.532651768517005e-10 ] [ -2.93174673479477e-09 -3.004843800071501e-10 -1.627456885046617e-09 ] [ 2.215316315514208e-09 4.69825973311386e-09 -5.876689316673773e-09 ] [ -3.349075612709595e-09 3.177016904095911e-10 4.140127247886255e-09 ] ] "source-value" [ [ 1.8540073 1.8329934 0.7281848 ] [ -4.5094901 -2.8126344 1.6298108 ] [ 0.5101852 -0.4512688 -0.4856956 ] [ 1.5192289 -0.8920431 0.1316947 ] [ 3.163558 -0.6202163 0.0956606 ] [ -1.8298524 -0.1875476 -1.0157787 ] [ 1.3826917 2.9324231 -3.667941 ] [ -2.0903286 0.1982938 2.5840642 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.703779852274444e-18 "source-value" -35.600194 } }