{ "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" [ 5.45189 0 0 ] "si-unit" "m" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103872 5.48254 0 ] "si-unit" "m" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0133572 0.0848103 5.46172 ] "si-unit" "m" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515087 0.139447 0.129479 ] [ 1.28089 1.29793 1.3896 ] [ -0.0267641 2.78569 2.67144 ] [ 1.28772 4.21003 3.97686 ] [ 2.71226 0.0930415 2.84614 ] [ 4.11731 1.46571 4.11351 ] [ 2.72029 2.73709 -0.0733662 ] [ 4.08924 4.18171 1.22387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15087e-12 1.39447e-11 1.29479e-11 ] [ 1.28089e-10 1.29793e-10 1.3896e-10 ] [ -2.67641e-12 2.78569e-10 2.67144e-10 ] [ 1.28772e-10 4.21003e-10 3.97686e-10 ] [ 2.71226e-10 9.304150000000001e-12 2.84614e-10 ] [ 4.11731e-10 1.46571e-10 4.11351e-10 ] [ 2.72029e-10 2.73709e-10 -7.336620000000001e-12 ] [ 4.089240000000001e-10 4.18171e-10 1.22387e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3800366 -3.3347982 -3.6551934 ] [ 3.2696468 3.420432 1.5846651 ] [ -0.5094268 0.2362389 -0.5699196 ] [ 0.6902122 0.2863453 2.0137512 ] [ 0.2039431 -1.0710165 -1.8463978 ] [ 0.1006239 0.2158101 0.247178 ] [ -1.2054631 0.0218792 0.4227601 ] [ -0.1694994 0.2251092 1.8031564 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.813238997168322e-09 -5.342935711125923e-09 -5.856265409982463e-09 ] [ 5.238551661233534e-09 5.480136183436185e-09 2.538913375017694e-09 ] [ -8.161917089689574e-10 3.784964425035091e-10 -9.131118588556877e-10 ] [ 1.105841850230934e-09 4.587757451359623e-10 3.226385092747945e-09 ] [ 3.267528667934764e-10 -1.715957596791043e-09 -2.958255387856555e-09 ] [ 1.612172600737171e-10 3.457658967525101e-10 3.960228127761024e-10 ] [ -1.931364796057092e-09 3.505434272180736e-11 6.773363484270702e-10 ] [ -2.715679759196275e-10 3.606646973669914e-10 2.888975027725893e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.01498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.770235895457959e-18 } }