{ "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" [ 5.11534 0 0 ] "si-unit" "m" "si-value" [ 5.11534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.215947 5.44617 0 ] "si-unit" "m" "si-value" [ -2.15947e-11 5.446170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.311017 -0.240161 5.43903 ] "si-unit" "m" "si-value" [ 3.11017e-11 -2.40161e-11 5.43903e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.11262 0.0410701 -0.0158461 ] [ 1.41877 1.4243 1.25044 ] [ 0.19719 2.45185 3.01922 ] [ 1.59796 4.1675 4.07229 ] [ 3.2205 -0.170535 2.05026 ] [ 3.94627 1.40202 3.6633 ] [ 2.60901 3.00439 -0.668036 ] [ 3.72698 4.31381 0.563179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1262e-11 4.10701e-12 -1.58461e-12 ] [ 1.41877e-10 1.4243e-10 1.25044e-10 ] [ 1.9719e-11 2.45185e-10 3.01922e-10 ] [ 1.59796e-10 4.1675e-10 4.07229e-10 ] [ 3.2205e-10 -1.70535e-11 2.05026e-10 ] [ 3.94627e-10 1.40202e-10 3.6633e-10 ] [ 2.60901e-10 3.00439e-10 -6.68036e-11 ] [ 3.726980000000001e-10 4.31381e-10 5.63179e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 163.53774710000002 155.33978150000002 -89.71597010000002 ] [ 4.820085300000001 1.8238154000000004 5.499149300000001 ] [ 198.06948880000004 152.52194120000001 -95.63744040000002 ] [ -40.723927200000006 35.80192280000001 -32.379066400000006 ] [ -62.00562710000001 71.22446670000001 107.29026470000002 ] [ -167.64262660000003 -179.33405560000003 69.26343590000002 ] [ 6.496878300000001 -18.809781400000002 47.13329190000001 ] [ -102.55201870000003 -218.56809070000006 -11.453664900000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.620163571806213e-07 2.488817682499655e-07 -1.437408309908626e-07 ] [ 7.72262804154688e-09 2.922074418609364e-09 8.810608515337457e-09 ] [ 3.173423068636847e-07 2.443670903629619e-07 -1.532280723444476e-07 ] [ -6.524692460455705e-08 5.736100416243186e-08 -5.187698361681451e-08 ] [ -9.934396691613719e-08 1.141141763158511e-07 1.71897955158015e-07 ] [ -2.685930992009069e-07 -2.873248335627769e-07 1.109722585895368e-07 ] [ 1.040914660620164e-08 -3.013659224972781e-08 7.551585896568147e-08 ] [ -1.643064481306711e-07 -3.501846878575328e-07 -1.835079427644594e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 86.119553 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.379787355471246e-17 } }