Search results

New version pixi error

Status: Open.

#64 In ZimmermanGroup/SlaterGPU;

· haolunc opened on Nov 21, 2025

MultiGPU runs seg fault

Status: Open.

#60 In ZimmermanGroup/SlaterGPU;

· Vaibhav-Chemistry opened on Sep 15, 2025

Configure pixi so it only recompiles when necessary

Status: Open.

#49 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Aug 13, 2025

pixi shell reruns cmake on every invocation even if nothing changed

Status: Open.

#46 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Aug 12, 2025

Instructions for running as a slurm job

Status: Open.

#45 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Aug 12, 2025

Becke grid bug

Status: Open.

#33 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Jul 3, 2025

Expand automated testing to multiple examples

Status: Open.

#30 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on May 23, 2025

Gaussian orbital example + test

Status: Open.

#25 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Mar 29, 2025

4 center integrals

Status: Open.

#24 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Jan 23, 2025

Investigate how to get nvhpc on gh actions gpu runner with pixi

Status: Open.

#23 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Jan 22, 2025

How to choose nrad / nang values for a molecule

Status: Open.

#15 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Nov 8, 2024

running examples doesn't match sample outputs

Status: Open.

#13 In ZimmermanGroup/SlaterGPU;

· joshkamm opened on Nov 5, 2024