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27 lattice building methods#28

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lucas-wilkins wants to merge 36 commits intomainSpinW/pySpinW:mainfrom 27-lattice-building-methodsSpinW/pySpinW:27-lattice-building-methodsCopy head branch name to clipboard

Commits

Commits on Nov 21, 2024

• Some structure code, not complete yet

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  4b2c1ce

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• Basic coupling stuff

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  313ba60

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Commits on Nov 25, 2024

• Some more coupling stuff, updated the size checking decorator with optional coercion to numpy

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• Final bits of coupling terms, triple product making fn, tests for that

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• Linting

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• A place for visualisations

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Commits on Nov 29, 2024

• Add anisotropy class

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• Add file for instrument class

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• Merge branch '27-lattice-building-methods' of https://github.com/SpinW/pySpinW into 27-lattice-building-methods

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  29c61f1

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• Proposal for fitting specification

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  eb921d2

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• Rename bad ADF file

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• Move Instrument from _base

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• Anisotropy outline, checks reference

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  8b9f0b8

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• Linting

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  353f4cd

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• Fixed util import in tests

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Commits on Dec 2, 2024

• Fill out anisotropy classes

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  75bc2a4

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Commits on Dec 16, 2024

• Filling out details, start docs

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Commits on Dec 18, 2024

• Initial system set up

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Commits on Jan 16, 2025

• Basic reading bits

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Commits on Jan 20, 2025

• mCif loading, initial stuff

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Commits on Jan 21, 2025

• Notation part I

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Commits on Jan 22, 2025

• Generators part II

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• More generator stuff

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Commits on Jan 27, 2025

• Debugging

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Commits on Jan 31, 2025

• More work towards having generators working correctly

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  11389d1

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• Removed stuff that went into a class

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  791c417

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• Return instance of Generator rather than tuples

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  14d984b

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Commits on Feb 10, 2025

• More work on generators

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  805bd2d

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Commits on Feb 11, 2025

• Better output for debug

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  33737c3

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Commits on Feb 12, 2025

• Added some rounding, still doesn't fix things

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  342fe2b

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• Fixed bug in rounding, now sure that the spglib symmetries are closed

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  2f722fa

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Commits on Feb 14, 2025

• More work on groups

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Commits on Feb 18, 2025

• crysFML file and parsing, not complete

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  4c0a8a6

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Commits on Feb 20, 2025

• Parsing works

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Commits on Feb 27, 2025

• Removed magnetic space group stuff

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Commits on Mar 14, 2025

• Start of main algo

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