Add lattice rules for (hyper)cubic grid integration#293
Open
Ao-chuba wants to merge 1 commit intotheochem:masterfrom
Open
Add lattice rules for (hyper)cubic grid integration#293Ao-chuba wants to merge 1 commit intotheochem:masterfrom
Ao-chuba wants to merge 1 commit intotheochem:masterfrom
Conversation
- Implement Lattice class with rank-1 lattice rules - Support embedded lattice rules (powers of 2) - Include tabulated generating vectors from UNSW (Order-2 weights) - Add comprehensive test suite (25 tests, all passing) - Support arbitrary parallelepipeds via affine transformation - Addresses issue theochem#241
This file contains hidden or bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Sign up for free
to join this conversation on GitHub.
Already have an account?
Sign in to comment
Add this suggestion to a batch that can be applied as a single commit.This suggestion is invalid because no changes were made to the code.Suggestions cannot be applied while the pull request is closed.Suggestions cannot be applied while viewing a subset of changes.Only one suggestion per line can be applied in a batch.Add this suggestion to a batch that can be applied as a single commit.Applying suggestions on deleted lines is not supported.You must change the existing code in this line in order to create a valid suggestion.Outdated suggestions cannot be applied.This suggestion has been applied or marked resolved.Suggestions cannot be applied from pending reviews.Suggestions cannot be applied on multi-line comments.Suggestions cannot be applied while the pull request is queued to merge.Suggestion cannot be applied right now. Please check back later.
This PR implements lattice rules for efficient numerical integration over (hyper)cubic grids, addressing issue #241 .
Following the references provided in the issue (Sloan's paper and the UNSW lattice rules database), I've implemented rank-1 lattice rules as a new integration method.
Implementation :
scipy.interpolate.LinearNDInterpolatorTesting: