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Std. Dev (ev/A) reads zero

Status: Open.

#441 In mir-group/flare;

· Vandemoo opened on Jul 27, 2025

Custom descriptor tutorial colab missing

Status: Open.

#440 In mir-group/flare;

· ltimmerman3 opened on Jul 25, 2025

Discrepancy in PotEng Between lmp-otf MD and Single-Point OTF/DFT for Water Molecules

Status: Open.

#432 In mir-group/flare;

· ShuaishuaiYuan opened on Nov 29, 2024

offline training of the Pt/H

Status: Open.

#431 In mir-group/flare;

· hewuanhewuan opened on Nov 26, 2024

Structure(cell, coded_species, pos, cutoff, descriptors) MemoryError: std::bad_alloc

Status: Open.

#429 In mir-group/flare;

· siinghim opened on Nov 18, 2024

Use descriptor-space mapping in ASE

Status: Open.

#428 In mir-group/flare;

· FromColleWithLove opened on Nov 9, 2024

Compilation error when building LAMMPS pair_flare_kokkos

Status: Open.

#427 In mir-group/flare;

· namehta4 opened on Nov 5, 2024

What happens when using three kernels and corresponding three descriptors, but only adding a two-dimensional sparse environment?

Status: Open.

#425 In mir-group/flare;

· rbjiawen opened on Nov 1, 2024

Executing flare-otf lammps.yaml on the command line results in an error

Status: Open.

#424 In mir-group/flare;

· 915936476 opened on Oct 28, 2024

AssertionError thermostat.shape

Status: Open.

#405 In mir-group/flare;

· rsdmse opened on Jul 12, 2024

Hyperparameter optimization giving abnormally high energy noise

Status: Open.

#403 In mir-group/flare;

· MorAnyAn opened on Jul 5, 2024

Supercell selection in offline training for 2 different systems

Status: Open.

#399 In mir-group/flare;

· taidbui opened on Apr 25, 2024