[CP2K-user] [CP2K:15055] Actinides

Vladimir Stegailov steg... at gmail.com
Thu Apr 1 04:34:09 UTC 2021


this GTH model for U has been tested for condensed systems
https://doi.org/10.1134/S199508021705033X

чт, 1 апр. 2021 г. в 02:53, aust... at gmail.com <
austin.d... at gmail.com>:

> Dear CP2K Community,
>
> Does any one know of pseudopotentials for actinides that could be used in
> condensed phases? I am examining actinide behavior in molten halide salts.
>
> Thank you,
> Austin
>
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