also it might be worth noting that if you want the same B3LYP as used in most other programs, e.g., Gaussian, you'll want to use the keyword b3lyp3.
regards,
-Kirk
From: <molpr...@googlegroups.com> on behalf of "andreas...@gmail.com" <andreas...@gmail.com>
Date: Friday, July 22, 2022 at 11:32 AM
To: molpro-user <molpr...@googlegroups.com>
Subject: [molpro-user] Re: How to compute excited state calculation (TDDFT)
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