deepmodeling abacus-develop Discussions
Discussions
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You must be logged in to vote Wrong result and low efficiency of integrated test 108_PW_RE_NEW with SG15 pseudopotential
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You must be logged in to vote Adding the switch for rotating the vacuum layer direction of 2D material to x direction to accelerate the calculation
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You must be logged in to vote Chinese Documents Needed？ 需要中文文档和教程？
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You must be logged in to vote project Molecular Dynamics trajectory onto a set of phonons
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You must be logged in to vote project time dependent wavefunction onto ground state wavefunction in TDDFT
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You must be logged in to vote support nspin=2 in tddft simulation
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You must be logged in to vote smaller time step cause earlier divergence in TDDFT
BugsBugs that only solvable with sufficient knowledge of DFT -
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