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criteria for oda damping value

Status: Open.

#142 In FermiQC/Fermi.jl;

· thudjx opened on May 4, 2024

OutOfMemoryError ?

Status: Open.

#140 In FermiQC/Fermi.jl;

· Nick-Mul opened on Nov 16, 2023

Question

good first issueGood for newcomersGood for newcomers

New ImplementationNew implementation of a methodNew implementation of a method

Status: Open.

#138 In FermiQC/Fermi.jl;

· Nick-Mul opened on May 22, 2023

energy difference

enhancementNew feature or requestNew feature or request

Status: Open.

#136 In FermiQC/Fermi.jl;

· maartenvd opened on Feb 8, 2023

TBLIS issue

Status: Open.

#132 In FermiQC/Fermi.jl;

· MarkoHorbatsch opened on Sep 3, 2022

IntegralHelper -- Generating Integrals

Status: Open.

#126 In FermiQC/Fermi.jl;

· gustavojra opened on May 23, 2022

Molecular Hamiltonian as LinearMap?

Status: Open.

#121 In FermiQC/Fermi.jl;

· msmerlak opened on Apr 26, 2022

supporting AtomsBase

Status: Open.

#120 In FermiQC/Fermi.jl;

· rkurchin opened on Mar 25, 2022

RHF with H2 errors

good first issueGood for newcomersGood for newcomers

HartreeFockconcerning HF methodsconcerning HF methods

Status: Open.

#119 In FermiQC/Fermi.jl;

· mtfishman opened on Jan 21, 2022

Non-concrete Atom types in Molecule

Status: Open.

#118 In FermiQC/Fermi.jl;

· thchr opened on Jan 21, 2022

Desireble feature: Projected CC amplitudes

CoupledClusterCoupled cluster related issuesCoupled cluster related issues

Status: Open.

#106 In FermiQC/Fermi.jl;

· gustavojra opened on Sep 7, 2021

Orbitals objects are not within "best practices"

enhancementNew feature or requestNew feature or request

Status: Open.

#105 In FermiQC/Fermi.jl;

· gustavojra opened on Aug 30, 2021