Search results

Problem facing while doing 2000 iterations in mcmc

Status: Open.

#270 In PhasesResearchLab/ESPEI;

· syamadas80-a11y opened on Aug 18, 2025

Compute phase composition when computing driving forces with unknown phase compositions

Status: Open.

#261 In PhasesResearchLab/ESPEI;

· bocklund opened on Oct 21, 2024

Endmembers wrapped in sublattices for fixed configuration datasets should behave as endmembers

Status: Open.

#260 In PhasesResearchLab/ESPEI;

· bocklund opened on Aug 21, 2024

Consider using pydantic instead of cerberus for the schema and validation

Status: Open.

#250 In PhasesResearchLab/ESPEI;

· bocklund opened on Nov 28, 2023

formatted_parameter broken by SymEngine

Status: Open.

#238 In PhasesResearchLab/ESPEI;

· bocklund opened on Jul 11, 2022

Memory leak when running MCMC in parallel

Status: Open.

#230 In PhasesResearchLab/ESPEI;

· bocklund opened on May 3, 2022

Unable to use activity data in binary Fe-C with Graphite as reference state

Status: Open.

#226 In PhasesResearchLab/ESPEI;

· tobiasspt opened on Feb 16, 2022

ENH: Allow multiple datasets directories to be specified in YAML input

Status: Open.

#214 In PhasesResearchLab/ESPEI;

· bocklund opened on Oct 4, 2021

DOC: Document how weights work

documentation

Status: Open.

#213 In PhasesResearchLab/ESPEI;

· bocklund opened on Sep 29, 2021

MCMC step stucked using the ESPEI 0.8.3 version

Status: Open.

#189 In PhasesResearchLab/ESPEI;

· HaihuiZhang opened on May 10, 2021

DOC: more clearly motivate _why_ ESPEI exists and _who_ should use it

documentation

Status: Open.

#175 In PhasesResearchLab/ESPEI;

· bocklund opened on Apr 24, 2021

DOC: unify the <code>README.rst</code> and <code>docs/index.rst</code>

Status: Open.

#172 In PhasesResearchLab/ESPEI;

· bocklund opened on Apr 20, 2021