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always print roots decrease

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edoapra 2023-02-02 18:05:53 -08:00
parent a091110664
commit b80cc23ce6
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2
src/nwdft/lr_tddft/tddft_iguess.F
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@ -371,7 +371,7 @@ c
else if (lewin) then
if (nroots.gt.newin) nroots = newin
else if (nroots.gt.nov(1)+nov(2)) then
if (nodezero.and.util_print('initial guess',print_default))
if (nodezero.and.util_print('initial guess',print_low))
1 write(LuOut,9040) nroots,nov(1)+nov(2)
nroots=nov(1)+nov(2)
if (.not.rtdb_put(rtdb,'tddft:nroots',mt_int,1,nroots))