{ "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" [ [ 1.7651436 1.7382701 0.4324592 ] [ -4.7442116 -3.1549145 2.3200829 ] [ 0.5487196 -0.3643451 -0.4679747 ] [ 1.4005432 -0.7544924 -0.0900827 ] [ 2.939922 -0.4525776 0.1693938 ] [ -1.8346254 -0.1380597 -0.9086825 ] [ 1.9732865 3.2611792 -4.0050202 ] [ -2.0487779 -0.13506 2.5498242 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.828071831574642e-09 2.785015737800844e-09 6.928760253983327e-10 ] [ -7.601064972271753e-09 -5.054730294167792e-09 3.717182611322958e-09 ] [ 8.791457217378263e-10 -5.837452059323934e-10 -7.497781296431598e-10 ] [ 2.243917589947588e-09 -1.208830093810581e-09 -1.443283970676318e-10 ] [ 4.710274334182548e-09 -7.251092557917984e-10 2.713987883044692e-10 ] [ -2.939393948022903e-09 -2.211960254370498e-10 -1.455869869224705e-09 ] [ 3.161553522487641e-09 5.224985113526812e-09 -6.416749783138006e-09 ] [ -3.282504079635589e-09 -2.1638997618804e-10 4.085268754047742e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.580094 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.70055952423236e-18 } }