mirror of
https://github.com/nwchemgit/nwchem.git
synced 2026-07-28 22:25:48 -04:00
Removed some typo's.
This commit is contained in:
parent
b714f29a80
commit
22ace03318
1 changed files with 2 additions and 2 deletions
|
|
@ -63,12 +63,12 @@ In addition, automatic interfaces are provided to
|
|||
The following methods for including relativity in quantum chemistry
|
||||
calculations are available:
|
||||
\begin{itemize}
|
||||
\item Spin-free one-electron Douglas-Kroll approximation is available for all
|
||||
\item The spin-free one-electron Douglas-Kroll approximation is available for all
|
||||
quantum mechanical methods and their gradients.
|
||||
\item Dyall's spin-free Modified Dirac Hamiltonian approximation is available
|
||||
for the Hartree-Fock method and its gradients.
|
||||
\item One-electron spin-orbit effects can be included via spin-orbit potentials.
|
||||
This option is available for DFT and its gradients, but hasto be run without
|
||||
This option is available for DFT and its gradients, but has to be run without
|
||||
symmetry.
|
||||
\end{itemize}
|
||||
|
||||
|
|
|
|||
Loading…
Add table
Add a link
Reference in a new issue