{ "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" [ [ -2.2417609 -2.8274318 -3.1938955 ] [ 2.7671579 2.8875359 1.5440578 ] [ -0.2859026 0.2468464 -0.2722789 ] [ 0.5842906 0.0608833 1.5400657 ] [ 0.0847304 -0.60414 -1.447313 ] [ -0.0651576 0.0282874 0.0415996 ] [ -0.7514037 0.2186959 0.4157646 ] [ -0.0919542 -0.0106771 1.3719998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.591696903403567e-09 -4.530045126866461e-09 -5.117184699378326e-09 ] [ 4.433475693442025e-09 4.626342510700687e-09 2.473853308323882e-09 ] [ -4.580664615459341e-10 3.954915310086451e-10 -4.362388879171411e-10 ] [ 9.361367390732045e-10 9.754579985715264e-11 2.467457259035987e-09 ] [ 1.357530659510323e-10 -9.67938983690112e-10 -2.318851051579911e-09 ] [ -1.043939833874381e-10 4.532141094321792e-11 6.664990655463168e-11 ] [ -1.203881440922617e-09 3.503894580448147e-10 6.661283218762637e-10 ] [ -1.473268694243674e-10 -1.710659999794368e-11 2.198186003302276e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.088815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.782065566537635e-18 } }