{ "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" [ [ 0.7455233 2.6119872 -0.374918 ] [ -1.4586261 1.060534 -0.6053852 ] [ 2.6142335 2.777406 -2.3898534 ] [ -1.3286267 0.9130194 -3.6606732 ] [ 0.9337548 -1.1667351 1.9108616 ] [ -2.5990916 -2.3523741 2.8399681 ] [ 3.6117653 -1.945926 1.9576393 ] [ -2.5189325 -1.8979115 0.3223608 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.194460001521665e-09 4.184864825668854e-09 -6.006848543170944e-10 ] [ -2.336976635908683e-09 1.699162780363507e-09 -9.69934014018332e-10 ] [ 4.188463795012157e-09 4.449894959669644e-09 -3.828967244619391e-09 ] [ -2.128694636510656e-09 1.462818337016843e-09 -5.865045017429123e-09 ] [ 1.49604011011978e-09 -1.86931569988675e-09 3.061537781104481e-09 ] [ -4.164203796837665e-09 -3.768918786395441e-09 4.550130493637796e-09 ] [ 5.786685923476698e-09 -3.117717143006861e-09 3.136483918419278e-09 ] [ -4.035774760873296e-09 -3.040789433647459e-09 5.164789372223847e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.327316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.820277639161378e-18 } }