Issues

• record.stdout is empty

  MolSSI/QCFractal#1026 · Filter by author jaclark5 opened on Aug 21, 2026

• List of roles

  MolSSI/QCFractal#1017 · Filter by author jnkrakowski opened on Jun 12, 2026

• Achieving both high speed in xTB and high accuracy in DFT.

  MolSSI/QCFractal#1006 · Filter by author Kamecs opened on May 31, 2026
  2

• Snowflake doesn't start up

  MolSSI/QCFractal#1000 · Filter by author jaclark5 opened on Apr 6, 2026
  1

• Error when creating dataset view

  MolSSI/QCFractal#984 · Filter by author jaclark5 opened on Feb 3, 2026
  2

• ds.status_by_compute_tag() doesn't report cancelled or complete?

  MolSSI/QCFractal#982 · Filter by author jaclark5 opened on Dec 19, 2025

• background_add_entries hangs (specific to Snowflake?)

  MolSSI/QCFractal#971 · Filter by author jaclark5 opened on Aug 22, 2025
  3

• TD Record Errors when Opt continues to have "running" status

  MolSSI/QCFractal#968 · Filter by author jaclark5 opened on Aug 8, 2025
  2

• XTB worker error: JSON loading

  MolSSI/QCFractal#949 · Filter by author jaclark5 opened on May 29, 2025

• message for required software

  MolSSI/QCFractal#936 · Filter by author loriab opened on Apr 25, 2025
  1

• FractalSnowflake error when using conda installation

  MolSSI/QCFractal#912 · Filter by author jaclark5 opened on Mar 18, 2025
  2

• Error with PostgreSQL with use of FractalSnowflake

  MolSSI/QCFractal#908 · Filter by author jaclark5 opened on Mar 12, 2025
  1

• Are there any PySCF data on QCArchive

  MolSSI/QCFractal#873 · Filter by author jhmlam opened on Dec 23, 2024
  2

• [Question] Number of task with MPI applications

  MolSSI/QCFractal#859 · Filter by author FNTwin opened on Dec 3, 2024
  1

• Worker getting removed

  MolSSI/QCFractal#850 · Filter by author FNTwin opened on Oct 8, 2024
  18

• Slow retrieval of trajectories inside and optimization

  MolSSI/QCFractal#842 · Filter by author chrisiacovella opened on May 25, 2024

• Behavior if specification doesn't exist in a record

  MolSSI/QCFractal#805 · Filter by author chrisiacovella opened on Mar 15, 2024

• Allow compute managers to use micromamba

  Compute
  MolSSI/QCFractal#779 · Filter by author bennybp opened on Oct 20, 2023

• Why do some records have error set?

  MolSSI/QCFractal#772 · Filter by author peastman opened on Oct 14, 2023
  21

• Wrong typecasting in records

  MolSSI/QCFractal#766 · Filter by author chrisiacovella opened on Oct 5, 2023
  1

• Optimization + Singlepoint workflow

  MolSSI/QCFractal#748 · Filter by author bennybp opened on Sep 14, 2023

• Local data persistence & caching

  InterfacePerformance
  MolSSI/QCFractal#740 · Filter by author chrisiacovella opened on Sep 5, 2023
  6

• Some datasets have placeholder spec names after migration

  MolSSI/QCFractal#739 · Filter by author j-wags opened on Aug 31, 2023
  7

• Make base_folder optional

  MolSSI/QCFractal#733 · Filter by author hadim opened on Jun 24, 2023

• FractalComputeConfig inherit from BaseSettings instead of BaseModel

  MolSSI/QCFractal#729 · Filter by author hadim opened on Jun 22, 2023
  2