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deepmodeling / ABACUS-agent-tools Public

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Tool to convert between conventional and primitive cell#110

Merged

pxlxingliang merged 5 commits intodeepmodeling:developdeepmodeling/ABACUS-agent-tools:developfrom

ahxbcn:conv_prim_cellahxbcn/abacus-agent:conv_prim_cellCopy head branch name to clipboard

Mar 13, 2026

Conversation Commits5 (5)Checks Files changed

Merged

Tool to convert between conventional and primitive cell#110
pxlxingliang merged 5 commits intodeepmodeling:developfrom
ahxbcn:conv_prim_cell

Commits

Commits on Mar 3, 2026

refactor: reformat tool to build slab
ahxbcn
committed
feat: tools to convert to primitive cell and conventional cell
ahxbcn
committed

Commits on Mar 4, 2026

refactor: rename name of tool functions for transform between conventional and primitive cell
ahxbcn
committed
feat: unittest for tool to convert between conventional and primitive cell
ahxbcn
committed
fix: update type hint of return value in abacus_cal_band
ahxbcn
committed

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