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start_magnetization in magnetism.cpp should be refactored

BugsBugs that only solvable with sufficient knowledge of DFTBugs that only solvable with sufficient knowledge of DFT

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#5787 In deepmodeling/abacus-develop;

· mohanchen opened on Dec 31, 2024

The function of checking the format of the training dataset needs to be enhanced in deepks

Machine LearningIssues related to the DeePKSIssues related to the DeePKS

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#5747 In deepmodeling/abacus-develop;

· Chentao168 opened on Dec 20, 2024

Need subspace diagonalization without scc

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#5615 In deepmodeling/abacus-develop;

· Cstandardlib opened on Nov 26, 2024

Hard-coded variables in DFT code

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#5594 In deepmodeling/abacus-develop;

· BariumOxide13716 opened on Nov 25, 2024

Minimize-LCAO-Memory: <code>DMK</code>

MemoryMemory issuesMemory issues

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#4218 In deepmodeling/abacus-develop;

· dyzheng opened on May 23, 2024

Minimize-LCAO-Memory: <code>hRGint</code> and <code>DMRGint</code>

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#4217 In deepmodeling/abacus-develop;

· dyzheng opened on May 23, 2024

Minimize-LCAO-Memory: <code>FFT::grid</code> and <code>rho</code> and <code>potential</code>

MemoryMemory issuesMemory issues

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#4216 In deepmodeling/abacus-develop;

· dyzheng opened on May 23, 2024

Large Memory Consumption of Calculation of Fe

MemoryMemory issuesMemory issues

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#3852 In deepmodeling/abacus-develop;

· ieiue opened on Mar 30, 2024

Memory record in LCAO code is not correct

MemoryMemory issuesMemory issues

RefactorRefactor ABACUS codesRefactor ABACUS codes

Status: Open.

#3831 In deepmodeling/abacus-develop;

· dyzheng opened on Mar 27, 2024