{ "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" [ [ 0.3657559 -0.4686742 -2.0118465 ] [ -0.1998434 -0.0506339 0.4846291 ] [ -0.0514048 -0.380462 -0.622791 ] [ -1.3862196 -1.1362154 4.0598293 ] [ 1.7055276 1.0774689 -1.9036237 ] [ -0.7369425 0.5360143 2.3432543 ] [ 0.3971467 -0.2490277 -2.8717855 ] [ -0.0940199 0.67153 0.522334 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.860055518996627e-10 -7.508988460121434e-10 -3.223333426938307e-09 ] [ -3.201844233011827e-10 -8.112445079992512e-11 7.764614137793453e-10 ] [ -8.235956875689984e-11 -6.095673215028097e-10 -9.978211798446529e-10 ] [ -2.220968634414728e-09 -1.82041775007292e-09 6.504563588898829e-09 ] [ 2.732556446849134e-09 1.726295481219093e-09 -3.049941386940793e-09 ] [ -1.180712044373904e-09 8.587895798744776e-10 3.75430725604907e-09 ] [ 6.362991577678715e-10 -3.989863588715961e-10 -4.601107588052439e-09 ] [ -1.506364856699539e-10 1.075909666165824e-09 8.368713230489471e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.905743038775913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.708598625397912e-18 } }