{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4403435 -0.4982972 -1.6389108 ] [ -0.2216204 -0.1137033 0.6189417 ] [ -0.0285859 -0.5130395 -1.0084505 ] [ -1.7762355 -1.466581 4.6955825 ] [ 2.1056881 1.2958379 -2.8680916 ] [ -0.8813174 0.5496436 2.2219405 ] [ 0.3852033 -0.1676809 -2.6677379 ] [ -0.0234758 0.9138204 0.6467262 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.055080608212448e-10 -7.983601240501017e-10 -2.625824567336625e-09 ] [ -3.550750235723443e-10 -1.821727689678086e-10 9.916539213782075e-10 ] [ -4.579966066452673e-11 -8.219798924469217e-10 -1.61571581433407e-09 ] [ -2.845842991134999e-09 -2.349721790709485e-09 7.523152502537616e-09 ] [ 3.373684244516773e-09 2.076161187726568e-09 -4.595189307832865e-09 ] [ -1.412026133784242e-09 8.80626125692347e-10 3.559941121908663e-09 ] [ 6.171637215150087e-10 -2.686544177347027e-10 -4.274187293802089e-09 ] [ -3.761237791457665e-11 1.464101680490104e-09 1.036169597698825e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.719857 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.722951978371922e-18 } }