{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] "source-value" [ 5.45189 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] "source-value" [ 0.103872 5.48254 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] "source-value" [ -0.0133572 0.0848103 5.46172 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.208395589573487e-08 -1.161556132303827e-08 -1.319906377423454e-08 ] [ 1.203714061531042e-08 1.154309199056157e-08 1.176844069575969e-08 ] [ -4.854056829679412e-10 -1.739300509067789e-10 -6.743619075305549e-10 ] [ 7.139976742995398e-10 4.174855707883391e-10 1.885979137831381e-09 ] [ -4.604505003576845e-10 -3.820253967284832e-10 -1.799731246633461e-09 ] [ 5.861242731872639e-10 -1.49855584784976e-10 3.681343652084851e-10 ] [ -8.460764686060915e-10 2.272442403581818e-10 1.473847080003782e-10 ] [ 5.386259848693652e-10 1.335502333150944e-10 1.503217861380964e-09 ] ] "source-value" [ [ -7.5422121 -7.2498632 -8.2382077 ] [ 7.5129923 7.2046314 7.345283 ] [ -0.3029664 -0.1085586 -0.4209036 ] [ 0.4456423 0.260574 1.1771356 ] [ -0.2873906 -0.2384415 -1.1233039 ] [ 0.36583 -0.0935325 0.2297714 ] [ -0.5280794 0.1418347 0.0919903 ] [ 0.3361839 0.0833555 0.9382348 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.750346073777138e-18 "source-value" -60.856874 } }