Quick start

For information regarding installation, compilation, configuration, etc., see the "Quick start" page.

OpenMolcas development

For information about how to contribute to OpenMolcas see "Development".

For documenting keyword syntax and validating input files, refer to "XML syntax documentation".
Untested modules and keywords: report.md.

About modernizing the OpenMolcas to current standards: "Progress".

Map of relevant places: https://molcas.gitlab.io/OpenMolcas/map/.

Documentation

The HTML documentation built from the sphinx format can be found at https://molcas.gitlab.io/OpenMolcas/sphinx/. The corresponding PDF can be found here.

The source code documentation built with doxygen can be found at https://molcas.gitlab.io/OpenMolcas/doxygen/index.xhtml.

Other documents

⚠️ This section is ported from the old Molcas documentation and at least part of it may not be up to date or relevant to OpenMolcas. ⚠️

• Git user manual
• Fortran standards
• Programming guide