Lkind check allows for irreducible exciton calculation#224
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palful wants to merge 2 commits intoyambo-code:5.4from
Open
Lkind check allows for irreducible exciton calculation#224palful wants to merge 2 commits intoyambo-code:5.4from
palful wants to merge 2 commits intoyambo-code:5.4from
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As discussed with Alberto, currently a check at line 166 of
K_driver_initwould not acceptLkind='tilde'as input option for irreducible exciton calculations, although this case is coded below at line 266 of the same file and also documented at input generation viaINIT_load.The change simply recognizes
Lkind='tilde'as an option to switch off the exchange part of the BSE kernel.Also note that
is equivalent - but more straightforward - to