Skip to content

Commit

Permalink
Merge pull request brucefan1983#657 from brucefan1983/correct_doc_vir…
Browse files Browse the repository at this point in the history
…ial_out

correct typo in doc
  • Loading branch information
brucefan1983 authored Jun 27, 2024
2 parents aebb734 + 5b45823 commit 6cd079f
Show file tree
Hide file tree
Showing 2 changed files with 2 additions and 2 deletions.
2 changes: 1 addition & 1 deletion doc/nep/output_files/stress_out.rst
Original file line number Diff line number Diff line change
Expand Up @@ -14,6 +14,6 @@ There are 12 columns.
The first 6 columns give the :math:`xx`, :math:`yy`, :math:`zz`, :math:`xy`, :math:`yz`, and :math:`zx` stress components calculated using the :term:`NEP` model.
The last 6 columns give the corresponding target stress components.

For a structure without target virial or stress, a target value of -1e-6 will be output to remind the user about this.
For a structure without target virial or stress, a target value of -1e6 will be output to remind the user about this.

The stress values are in units of GPa.
2 changes: 1 addition & 1 deletion doc/nep/output_files/virial_out.rst
Original file line number Diff line number Diff line change
Expand Up @@ -14,6 +14,6 @@ There are 12 columns.
The first 6 columns give the :math:`xx`, :math:`yy`, :math:`zz`, :math:`xy`, :math:`yz`, and :math:`zx` virial components calculated using the :term:`NEP` model.
The last 6 columns give the corresponding target virials.

For a structure without target virial or stress, a target value of -1e-6 will be output to remind the user about this.
For a structure without target virial or stress, a target value of -1e6 will be output to remind the user about this.

The virial values are in units of eV/atom.

0 comments on commit 6cd079f

Please sign in to comment.