{ "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" [ [ 4.5619842 4.3633877 1.3070316 ] [ -13.4298909 -7.8886981 6.7236078 ] [ 1.1530546 -1.1519025 -1.4715749 ] [ 3.0372742 -2.4153042 0.8002729 ] [ 5.5607379 -1.319201 0.5701561 ] [ -3.6843837 0.3027088 -1.6837601 ] [ 7.2687942 9.0526355 -11.1875978 ] [ -4.4675705 -0.9436262 4.9418643 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.309104489917183e-09 6.990917818023001e-09 2.094095489419634e-09 ] [ -2.151705739714923e-08 -1.263908776850019e-08 1.077240731334014e-08 ] [ 1.847397137846216e-09 -1.845551270146185e-09 -2.357722919960887e-09 ] [ 4.866249754291043e-09 -3.869743953242063e-09 1.282178541203418e-09 ] [ 8.909284331178229e-09 -2.113593017749434e-09 9.134907811525675e-10 ] [ -5.903033474830466e-09 4.849929662661792e-10 -2.697681089481503e-09 ] [ 1.164589222459472e-08 1.45039210742189e-08 -1.792450778574981e-08 ] [ -7.157837065847696e-09 -1.511855848870211e-09 7.917739509858765e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.726801 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.403629250176784e-18 } }