{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0730173 2.0456476 -0.6659468 ] [ -0.9804209 0.8187855 -0.4395166 ] [ 1.9671663 1.9566806 -1.7669251 ] [ -0.5502488 1.0926316 -2.8987965 ] [ 0.381894 -1.1400127 1.5015518 ] [ -1.9809882 -1.6805484 2.4697819 ] [ 2.7540299 -1.484965 1.3622624 ] [ -1.6644497 -1.6082192 0.437589 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169866119377682e-10 3.277488786118178e-09 -1.066964402447071e-09 ] [ -1.570807457465251e-09 1.311838996358007e-09 -7.041832267751244e-10 ] [ 3.151747881052233e-09 3.1349479375211e-09 -2.830926109248113e-09 ] [ -8.815957702465391e-10 1.750588819090034e-09 -4.64438401902098e-09 ] [ 6.11861643464796e-10 -1.826501710403251e-09 2.405751208700641e-09 ] [ -3.173893006269719e-09 -2.692535378786085e-09 3.957026851256124e-09 ] [ 4.412442355117356e-09 -2.37917622530781e-09 2.182584986656762e-09 ] [ -2.66674241780831e-09 -2.576651224590173e-09 7.010948710954259e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.524148074190162 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.089419364722358e-18 } }