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Firefly version 8.0.0 - suggested minor enhancements.

Pavel Strashnov
paulvstrashnov@mail.ru


Dear Alex,
Dear FireFly Community,

here are two thoughts about improvements that could make our life easier.

1. Output file of runtyp=rsurface runs often become enormous. Mainly because of "INTERNAL COORDINATES" blocks. It would be great to have ability to skip printing internals each step by using nprint=-5 (minimal output).

2. ECPs input is very unfriendly (both preprocessing technique and creation of external basis set file). It was discussed here several times.


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