{ "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" [ 5.45804 0 0 ] "si-unit" "m" "si-value" [ 5.45804e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0357167 5.39587 0 ] "si-unit" "m" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.019829 -0.0610013 5.23355 ] "si-unit" "m" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2505597 5.6290281 5.6620792 ] [ -7.395386 -7.3839652 5.104193 ] [ -3.8154641 -7.726268 -5.1196319 ] [ 7.9668979 -1.4424725 2.4514591 ] [ 0.4751546 2.3295374 -2.2711782 ] [ 1.8175584 0.4942795 0.086712 ] [ 5.9502049 6.2719266 -4.4452193 ] [ 0.2515941 1.8279341 -1.4684139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.412323997454661e-09 9.018697219646245e-09 9.071650919357968e-09 ] [ -1.184871455099163e-08 -1.18304164122408e-08 8.177818692651015e-09 ] [ -6.113047378521713e-09 -1.237884595563518e-08 -8.202554537281883e-09 ] [ 1.276437755568062e-08 -2.311095715646928e-09 3.927670456867409e-09 ] [ 7.612815913855756e-10 3.732330359559218e-09 -3.638828613710627e-09 ] [ 2.912049575418655e-09 7.919230590407136e-10 1.389279391428096e-10 ] [ 9.533279179749603e-09 1.004873416589363e-08 -7.122026436788941e-09 ] [ 4.030981849512173e-10 2.92867327938309e-09 -2.352658420237749e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.548007038775918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.529759365276061e-18 } }