{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5503547 1.3509707 -0.0983653 ] [ -0.7278626 0.013898 0.4174374 ] [ -0.2047872 -1.3022272 0.2436515 ] [ 1.7089289 -0.2695758 1.4882973 ] [ 0.2730456 0.3809764 0.4960588 ] [ 0.4244146 -0.4684289 -1.2222778 ] [ -0.5969318 0.9251705 -0.6591765 ] [ -1.4271622 -0.6307836 -0.6656254 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.817654407520797e-10 2.164493688758624e-09 -1.575985852564002e-10 ] [ -1.166164450482488e-09 2.2267050859332e-11 6.688084484377115e-10 ] [ -3.281052667822848e-10 -2.086397991999244e-09 3.903727401390509e-10 ] [ 2.738005952747323e-09 -4.319080478518571e-10 2.384515158505288e-09 ] [ 4.374672803365103e-10 6.103914861854375e-10 7.947738184500792e-10 ] [ 6.799871552484563e-10 -7.505058382703225e-10 -1.958304931416925e-09 ] [ -9.563901820515612e-10 1.482286557566097e-09 -1.056117185981901e-09 ] [ -2.286565929768034e-09 -1.010626745030402e-09 -1.066449462876904e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.795205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.933935789023996e-18 } }