mirror of
https://github.com/TREX-CoE/trexio.git
synced 2024-12-22 20:35:44 +01:00
Fixed equation
This commit is contained in:
parent
212daf43be
commit
d00fb62f83
2
trex.org
2
trex.org
@ -124,7 +124,7 @@ arrays are 0-based. Hence, we introduce the ~index~ type which is an
|
||||
V_{A \ell}(\mathbf{r}) =
|
||||
\sum_{q=1}^{N_{q \ell}}
|
||||
\beta_{A q \ell}\, |\mathbf{r}-\mathbf{R}_{A}|^{n_{A q \ell}}\,
|
||||
e^{-\alpha_{A q \ell} |\mathbf{r}-\mathbf{R}_A|^2 }}
|
||||
e^{-\alpha_{A q \ell} |\mathbf{r}-\mathbf{R}_{A}|^2 }
|
||||
\]
|
||||
|
||||
See http://dx.doi.org/10.1063/1.4984046 for more info.
|
||||
|
Loading…
Reference in New Issue
Block a user