Search results

xtb-python to tblite

Type: Feature

Status: Open.

#899 In ReactionMechanismGenerator/ARC;

· kfir4444 opened on Jun 14, 2026

Identify proper LOT format by software

Type: Feature

Status: Open.

#896 In ReactionMechanismGenerator/ARC;

· alongd opened on Jun 8, 2026

Not recognising family since 3.12 update

Type: Bug

Status: Open.

#813 In ReactionMechanismGenerator/ARC;

· calvinp0 opened on Jan 5, 2026

Issue with deremining reaction family under the new functionality

Type: Bug

Status: Open.

#787 In ReactionMechanismGenerator/ARC;

· kfir4444 opened on Apr 23, 2025

Mismatch in Angles After Z-matrix to XYZ Conversion in zmat_to_xyz

Type: Bug

Status: Open.

#779 In ReactionMechanismGenerator/ARC;

· LeenFahoum opened on Dec 26, 2024

ARC's troubleshooting: Orca's mdci error

Type: Bug

Status: Open.

#769 In ReactionMechanismGenerator/ARC;

· NellyMitnik opened on Nov 9, 2024

How to use ARC only on PC without clustering software?

Type: QuestionGood for newcomersGood for newcomers

Status: Open.

#742 In ReactionMechanismGenerator/ARC;

· OJ-0908 opened on May 11, 2024

trsh: scan_qualitiy_check

Type: Bug

Status: Open.

#741 In ReactionMechanismGenerator/ARC;

· NellyMitnik opened on May 7, 2024

parse_frequencies doesn't parse imaginary frequencies correctly.

Good first issue

Module: Parser

Type: Bug

Status: Open.

#739 In ReactionMechanismGenerator/ARC;

· kfir4444 opened on Apr 27, 2024

Could not determine reaction family for reaction C3H6-2 + O <=> C3H6O

Type: Bug

Status: Open.

#738 In ReactionMechanismGenerator/ARC;

· kfir4444 opened on Apr 15, 2024

Consider implementing MRCC

Type: Feature

Status: Open.

#731 In ReactionMechanismGenerator/ARC;

· alongd opened on Feb 12, 2024

Unblocking Python 3.11

Type: Feature

Status: Open.

#725 In ReactionMechanismGenerator/ARC;

· alongd opened on Jan 18, 2024