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dft_tools/test/python/w90_convert
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AlynJ c202286341
Elk Transport code and subsequent updates (#229) 
* elk-transport
* minor updates
* specify explicitly fortran compiler and python exe in CMAKE

Co-authored-by: Alexander Hampel <ahampel@flatironinstitute.org>
2023-01-04 17:16:57 -05:00
..
LaVO3-Pbnm_hloc_diag.ref.h5
Elk Transport code and subsequent updates (#229)
2023-01-04 17:16:57 -05:00
LaVO3-Pbnm_hr.dat
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
LaVO3-Pbnm.inp
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
LaVO3-Pnma_ef_hr.dat
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
LaVO3-Pnma_ef.inp
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
LaVO3-Pnma_hr.dat
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
LaVO3-Pnma_lambda.ref.h5
Elk Transport code and subsequent updates (#229)
2023-01-04 17:16:57 -05:00
LaVO3-Pnma_wannier.ref.h5
Elk Transport code and subsequent updates (#229)
2023-01-04 17:16:57 -05:00
LaVO3-Pnma.inp
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col_blochbasis.ref.h5
Elk Transport code and subsequent updates (#229)
2023-01-04 17:16:57 -05:00
SrVO3_col_hr.dat
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col_u_dis.mat
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col_u.mat
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col_wannierbasis.ref.h5
Elk Transport code and subsequent updates (#229)
2023-01-04 17:16:57 -05:00
SrVO3_col.eig
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col.inp
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col.LOCPROJ
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col.nnkp
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col.OUTCAR
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_col.wout
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_soc_hr.dat
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_soc.inp
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_soc.ref.h5
Elk Transport code and subsequent updates (#229)
2023-01-04 17:16:57 -05:00
SrVO3_t2g_col_hr.dat
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00
SrVO3_t2g_col_lambda.ref.h5
Elk Transport code and subsequent updates (#229)
2023-01-04 17:16:57 -05:00
SrVO3_t2g_col.inp
Updated W90 converter: bug fixes for SOC, code restructured, more tests for add_lambda and bloch_basis
2022-04-15 10:51:37 -04:00