[Feature] TD-OFDFT #6538
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[Feature] TD-OFDFT #6538
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mohanchen
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Sep 27, 2025
mohanchen
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sunliang98
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Sep 27, 2025
kirk0830
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Sep 28, 2025
kirk0830
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Sep 28, 2025
kirk0830
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Sep 28, 2025
kirk0830
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Sep 28, 2025
kirk0830
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mohanchen
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Sep 30, 2025
Cstandardlib
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Sep 30, 2025
* add esolver_of_tddft * esolver_of_tddft cmakelist * move memeber function of esolver_of_tddft to module_ofdft * fix bug (confuse evolve_psi with evolve_phi) * change evolve_phi with evolve_ofdft; change to vector * details * code optimization * add situation of reading charge file for tdofdft --------- Co-authored-by: Liang Sun <[email protected]>
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The main features of TD-OFDFT have been implemented in this PR.
TD-OFDFT code can run normally now.
But the accuracy of the result compared with PROFESS is not tested yet. Tests and documents are not added yet.