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Make Davidson subspace max_subspace_iter parameter available to user#203

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jonasleitner merged 4 commits intoadc-connect:masterfrom
fedy9:fix_subspace_diag_param
Mar 3, 2026
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Make Davidson subspace max_subspace_iter parameter available to user#203
jonasleitner merged 4 commits intoadc-connect:masterfrom
fedy9:fix_subspace_diag_param

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@fedy9 fedy9 commented Feb 26, 2026

If the subspace gets to large, the subspace diagonalization of the scipy linear algebra solver may run into the default max iterations. Setting this parameter was not available from the adcc user side

@fedy9 fedy9 changed the title Make Davidson subspace max_iter parameter available to user Make Davidson subspace max_subspace_iter parameter available to user Feb 27, 2026
@jonasleitner jonasleitner force-pushed the fix_subspace_diag_param branch from 7b9e465 to f29237e Compare March 2, 2026 14:38
Comment thread adcc/solver/davidson.py Outdated
fedy9 and others added 2 commits March 2, 2026 21:29
Co-authored-by: jonasleitner <80265962+jonasleitner@users.noreply.github.com>
@jonasleitner jonasleitner merged commit 41444dd into adc-connect:master Mar 3, 2026
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2 participants