CCL: values for triangular bipyramidal (TBP) and square pyramidal (SP)
- From: David Shobe <shobedavid[a]gmail.com>
- Subject: CCL: values for triangular bipyramidal (TBP) and square
pyramidal (SP)
- Date: Tue, 25 Jan 2022 19:16:45 -0600
Arora--
Values of *what* for triangular bipyramidal and for square pyramidal?
Also, which program are you using?
--David Shobe
On Sat, Jan 22, 2022, 2:32 AM SUMANGLA ARORA arorasumangla/./gmail.com <
owner-chemistry%ccl.net> wrote:
>
> Sent to CCL by: "SUMANGLA ARORA" [arorasumangla[a]gmail.com]
> Dear All,
> How can we get the values for triangular bipyramidal (TBP) and square
> pyramidal (SP) geometry in the output file (DFT)?
>
> Thanks
> Sumangla>
>
>