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Option to use a stress tolerance instead of virial?

Status: Open.

#62 In JuliaMolSim/GeometryOptimization.jl;

· Technici4n opened on Jun 16, 2026

Variablecell does not converge

bugSomething isn't workingSomething isn't working

Status: Open.

#28 In JuliaMolSim/GeometryOptimization.jl;

· mfherbst opened on Jul 30, 2025

Register with General

Status: Open.

#3 In JuliaMolSim/GeometryOptimization.jl;

· cortner opened on Jan 16, 2024

Generalize atoms clamping

Status: Open.

#2 In JuliaMolSim/GeometryOptimization.jl;

· CedricTravelletti opened on Jan 9, 2024