{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.9724622 -20.4888746 -5.6860046 ] [ 51.886146 -18.3584568 -18.3233244 ] [ -13.5432465 57.8134111 27.6011966 ] [ 4.4597783 -5.2103893 -17.610323 ] [ -81.1415482 110.2444267 76.9506028 ] [ -21.7100908 -21.3591011 12.88829 ] [ 11.3816592 2.9963925 -2.1792297 ] [ 82.6397644 -105.6374084 -73.6412077 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.442988468785174e-08 -3.282679587062295e-08 -9.109983635881257e-09 ] [ 8.313077006461544e-08 -2.941349027892678e-08 -2.935720196901419e-08 ] [ -2.169867291203143e-08 9.262729563311922e-08 4.422199189862445e-08 ] [ 7.145352526211169e-09 -8.347963921726478e-09 -2.821484779533652e-08 ] [ -1.300030915015563e-07 1.766310430322393e-07 1.23288456762627e-07 ] [ -3.478339991520517e-08 -3.422105242372356e-08 2.064931692009043e-08 ] [ 1.823542827615323e-08 4.800750010240465e-09 -3.491510876692998e-09 ] [ 1.324034984701002e-07 -1.692497860203815e-07 -1.179862213044169e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 6.8653612 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.099952120798743e-18 } }