{ "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" [ [ 1.3253437 0.2284675 -1.6858536 ] [ 0.0617651 -0.5444849 1.8217898 ] [ 0.0497788 -0.9716522 -0.2901723 ] [ 0.3310074 0.5909053 2.8252197 ] [ -0.4747522 0.988656 -0.9700506 ] [ -0.5251147 0.5464504 0.2988692 ] [ 0.4920084 -0.4650239 -1.9785358 ] [ -1.2600366 -0.3733182 -0.0212664 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.123434690664569e-09 3.66045287112624e-10 -2.701035224011515e-09 ] [ 9.895859920137408e-11 -8.723609771586259e-10 2.918829025571908e-09 ] [ 7.975442957147904e-11 -1.556758438388886e-09 -4.649072750637638e-10 ] [ 5.303323175917939e-10 9.4673465676681e-10 4.52650095196359e-09 ] [ -7.606368755133658e-10 1.584001529213645e-09 -1.554192392313013e-09 ] [ -8.413264955784059e-10 8.755100553068084e-10 4.788412449171994e-10 ] [ 7.882843557172148e-10 -7.45050420693237e-10 -3.169963802175825e-09 ] [ -2.018801181872322e-09 -5.981216921591386e-10 -3.407252888858112e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -26.981236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.322870551948731e-18 } }