fix formatting and spelling
This commit is contained in:
@ -133,7 +133,7 @@ Currently two descriptor styles are available: *sna* and *so3*.
|
|||||||
*.mliap.descriptor* extension.
|
*.mliap.descriptor* extension.
|
||||||
|
|
||||||
- *so3* indicated the power spectrum component descriptors. A single additional
|
- *so3* indicated the power spectrum component descriptors. A single additional
|
||||||
argument specifies the descriptor filename containing the parameters and setting.
|
argument specifies the descriptor filename containing the parameters and setting.
|
||||||
|
|
||||||
The SNAP descriptor file closely follows the format of the
|
The SNAP descriptor file closely follows the format of the
|
||||||
:doc:`pair_style snap <pair_snap>` parameter file. The file can contain
|
:doc:`pair_style snap <pair_snap>` parameter file. The file can contain
|
||||||
@ -154,7 +154,7 @@ the elements are listed must be consistent for all three keywords.
|
|||||||
The SO3 descriptor file is similar to the SNAP descriptor except that it
|
The SO3 descriptor file is similar to the SNAP descriptor except that it
|
||||||
contains a few more arguments (e.g., *nmax* and *alpha*). The preparation
|
contains a few more arguments (e.g., *nmax* and *alpha*). The preparation
|
||||||
of SO3 descriptor and model files can be done with the
|
of SO3 descriptor and model files can be done with the
|
||||||
`*Pyxtal_FF*<https://github.com/qzhu2017/PyXtal_FF>`_ package.
|
`Pyxtal_FF <https://github.com/qzhu2017/PyXtal_FF>`_ package.
|
||||||
|
|
||||||
See the :doc:`pair_coeff <pair_coeff>` doc page for alternate ways
|
See the :doc:`pair_coeff <pair_coeff>` doc page for alternate ways
|
||||||
to specify the path for these *model* and *descriptor* files.
|
to specify the path for these *model* and *descriptor* files.
|
||||||
|
|||||||
@ -1856,6 +1856,7 @@ Matous
|
|||||||
matplotlib
|
matplotlib
|
||||||
Matsubara
|
Matsubara
|
||||||
Matteo
|
Matteo
|
||||||
|
Matteson
|
||||||
Mattice
|
Mattice
|
||||||
Mattox
|
Mattox
|
||||||
Mattson
|
Mattson
|
||||||
@ -3620,6 +3621,7 @@ xz
|
|||||||
xzhou
|
xzhou
|
||||||
yaff
|
yaff
|
||||||
yaml
|
yaml
|
||||||
|
Yanxon
|
||||||
YAFF
|
YAFF
|
||||||
Yamada
|
Yamada
|
||||||
Yaser
|
Yaser
|
||||||
@ -3692,6 +3694,7 @@ PowerShell
|
|||||||
filesystems
|
filesystems
|
||||||
fingerprintconstants
|
fingerprintconstants
|
||||||
fingerprintsperelement
|
fingerprintsperelement
|
||||||
|
Zagaceta
|
||||||
zincblende
|
zincblende
|
||||||
Zstandard
|
Zstandard
|
||||||
Zstd
|
Zstd
|
||||||
|
|||||||
Reference in New Issue
Block a user