{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0566375 1.2040858 0.4947758 ] [ -2.949136 -1.9143628 1.3060601 ] [ 0.1753841 -0.4177501 -0.2952487 ] [ 1.1219349 -0.5375723 -0.0553352 ] [ 1.8096105 -0.424132 0.1648261 ] [ -1.0855383 0.0914651 -0.7173526 ] [ 1.0937211 1.993762 -2.4942064 ] [ -1.2226139 0.0045044 1.5964808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.69291989916056e-09 1.929158118197265e-09 7.927182192976166e-10 ] [ -4.72503675075963e-09 -3.067147321889226e-09 2.09253895757971e-09 ] [ 2.809963046800492e-10 -6.693094435568621e-10 -4.730405644615929e-10 ] [ 1.797537866839586e-09 -8.612857710496839e-10 -8.865676374729216e-11 ] [ 2.899315635854199e-09 -6.795343745331457e-10 2.640805239176429e-10 ] [ -1.739224085242977e-09 1.465432448391341e-10 -1.149325564590094e-09 ] [ 1.752334376095659e-09 3.19435886383945e-09 -3.996159181529733e-09 ] [ -1.958843406845109e-09 7.216844370731521e-12 2.55784421331608e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.048205240654234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.731423586317625e-18 } }