Comments (2)
glwhart
commented on August 11, 2024
Is this still open?
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jerjorg
commented on August 11, 2024
Wiley and I got different representative k-points for the orbits but our representative k-points were symmetrically equivalent. We double checked this by verifying that the energy eigenvalues at symmetrically equivalent k-points were the same.
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Related Issues (16)
- Unfolding a reduced list HOT 1
- Export full list, partitioned into orbits
- Error in symmetryReduceKpointList HOT 9
- Incorrect orbits determined for BCC lattice HOT 6
- Memory Leak in generateIrredKpointList HOT 2
- Different number of irreducible k-points for equivalent k-lattices HOT 1
- The driver should read in an input file
- STOP: Input matrix is linearly dependent HOT 2
- Consistent equality checks between subroutines. HOT 4
- Bug in python wrapper? HOT 1
- undefined reference problem HOT 2
- Error in k-point folding routine. HOT 10
- Eliminating the search within a sphere when mapping points to first Brillouin zone HOT 1
- Confusing comment and line of code in generateKpoints.f90 HOT 7
- Error when lattice vectors have negative determinant HOT 1
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