fix: correct spelling of SpectraFit (#2102)

* chore: Refactor code structure for improved readability and maintainability

* fix: Update repository links to use consistent casing for SpectraFit

* Update docs/changelogs/v0.x.x.md

Co-authored-by: sourcery-ai[bot] <58596630+sourcery-ai[bot]@users.noreply.github.com>

* Update docs/changelogs/v0.x.x.md

Co-authored-by: sourcery-ai[bot] <58596630+sourcery-ai[bot]@users.noreply.github.com>

* Update README.md

Co-authored-by: sourcery-ai[bot] <58596630+sourcery-ai[bot]@users.noreply.github.com>

* Update README.md

Co-authored-by: Copilot <175728472+Copilot@users.noreply.github.com>

* Update docs/changelogs/v0.x.x.md

Co-authored-by: Copilot <175728472+Copilot@users.noreply.github.com>

---------

Co-authored-by: sourcery-ai[bot] <58596630+sourcery-ai[bot]@users.noreply.github.com>
Co-authored-by: Copilot <175728472+Copilot@users.noreply.github.com>

Author: 3 people

.devcontainer/README.md

@@ -19,7 +19,7 @@ This folder contains the configuration for the SpectraFit development container,
 
 ### Option 2: Using GitHub Codespaces
 
-1. Go to the [SpectraFit repository](https://github.com/Anselmoo/spectrafit)
+1. Go to the [SpectraFit repository](https://github.com/Anselmoo/SpectraFit)
 2. Click the green "Code" button
 3. Select "Codespaces" tab
 4. Click "Create codespace on main"
@@ -140,7 +140,7 @@ To change post-creation setup steps, edit `.devcontainer/setup.sh`:
 
 - [VS Code Dev Containers Documentation](https://code.visualstudio.com/docs/devcontainers/containers)
 - [Dev Container Features](https://containers.dev/features)
-- [SpectraFit Documentation](https://anselmoo.github.io/spectrafit/)
+- [SpectraFit Documentation](https://anselmoo.github.io/SpectraFit/)
 - [uv Documentation](https://docs.astral.sh/uv/)
 
 ## 🤝 Contributing

.github/pull_request_template.md

@@ -4,7 +4,7 @@
 
 - [ ] Have you followed the guidelines in our Contributing document?
 - [ ] Have you checked to ensure there aren't other open
-      [Pull Requests](https://github.com/Anselmoo/spectrafit/pulls) for the same
+      [Pull Requests](https://github.com/Anselmoo/SpectraFit/pulls) for the same
       update/change?
 
 <!-- You can erase any parts of this template not applicable to your Pull Request. -->

CHANGELOG.md

@@ -105,7 +105,7 @@ All notable changes to this project will be documented in this file.
 
 ### :package: Full Changelog
 
-**Full Changelog**: https://github.com/Anselmoo/spectrafit/compare/v1.3.0...v1.4.0
+**Full Changelog**: https://github.com/Anselmoo/SpectraFit/compare/v1.3.0...v1.4.0
 
 ### :gear: Who Contributes
 
@@ -157,7 +157,7 @@ All notable changes to this project will be documented in this file.
 
 ### :package: Full Changelog
 
-**Full Changelog**: https://github.com/Anselmoo/spectrafit/compare/v1.2.2...v1.3.0
+**Full Changelog**: https://github.com/Anselmoo/SpectraFit/compare/v1.2.2...v1.3.0
 
 ### :gear: Who Contributes
 
@@ -229,7 +229,7 @@ All notable changes to this project will be documented in this file.
 
 ### :package: Full Changelog
 
-**Full Changelog**: https://github.com/Anselmoo/spectrafit/compare/v1.2.1...v1.2.2
+**Full Changelog**: https://github.com/Anselmoo/SpectraFit/compare/v1.2.1...v1.2.2
 
 ### :gear: Who Contributes
 
@@ -295,7 +295,7 @@ All notable changes to this project will be documented in this file.
 
 ### :package: Full Changelog
 
-**Full Changelog**: https://github.com/Anselmoo/spectrafit/compare/v1.2.0...v1.2.1
+**Full Changelog**: https://github.com/Anselmoo/SpectraFit/compare/v1.2.0...v1.2.1
 
 ### :gear: Who Contributes
 
@@ -415,7 +415,7 @@ All notable changes to this project will be documented in this file.
 
 ### :package: Full Changelog
 
-**Full Changelog**: https://github.com/Anselmoo/spectrafit/compare/v1.1.0...v1.2.0
+**Full Changelog**: https://github.com/Anselmoo/SpectraFit/compare/v1.1.0...v1.2.0
 
 ### :gear: Who Contributes
 
@@ -562,7 +562,7 @@ All notable changes to this project will be documented in this file.
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.5...v1.1.0
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.5...v1.1.0
 
 ### :gear: Who Contributes
 
@@ -646,7 +646,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.5...v1.1.0
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.4...v1.0.5
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.4...v1.0.5
 
 ### :gear: Who Contributes
 
@@ -787,7 +787,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.4...v1.0.5
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.3.post2...v1.0.4
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.3.post2...v1.0.4
 
 ### :gear: Who Contributes
 
@@ -820,7 +820,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.3.post2...v1.0.4
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.3.post1...v1.0.4
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.3.post1...v1.0.4
 
 ### :gear: Who Contributes
 
@@ -853,7 +853,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.3.post1...v1.0.4
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.3.post0...v1.0.4
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.3.post0...v1.0.4
 
 ### :gear: Who Contributes
 
@@ -883,7 +883,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.3.post0...v1.0.4
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.3...v1.0.4
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.3...v1.0.4
 
 ### :gear: Who Contributes
 
@@ -905,7 +905,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.3...v1.0.4
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.2...v1.0.3
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.2...v1.0.3
 
 ### :gear: Who Contributes
 
@@ -1041,7 +1041,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.2...v1.0.3
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.1...v1.0.2
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.1...v1.0.2
 
 ### :gear: Who Contributes
 
@@ -1253,7 +1253,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.1...v1.0.2
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.0.post1...v1.1.0
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.0.post1...v1.1.0
 
 ### :gear: Who Contributes
 
@@ -1283,7 +1283,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.0.post1...v1.1.0
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.0.post0...v1.0.1
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.0.post0...v1.0.1
 
 ### :gear: Who Contributes
 
@@ -1415,7 +1415,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.0.post0...v1.0.1
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v1.0.0...v1.1.0
+https://github.com/Anselmoo/SpectraFit/compare/v1.0.0...v1.1.0
 
 ### :gear: Who Contributes
 
@@ -1453,7 +1453,7 @@ https://github.com/Anselmoo/spectrafit/compare/v1.0.0...v1.1.0
 ### :package: Full Changelog
 
 **Full Changelog**:
-https://github.com/Anselmoo/spectrafit/compare/v0.22.9...v0.22.10
+https://github.com/Anselmoo/SpectraFit/compare/v0.22.9...v0.22.10
 
 ### :gear: Who Contributes
 

CONTRIBUTING.md

@@ -21,9 +21,9 @@ help this project `SpectraFit`.
 
 Here are some important resources:
 
-- [Issues](https://github.com/Anselmoo/spectrafit/issues) for open BUG reports
+- [Issues](https://github.com/Anselmoo/SpectraFit/issues) for open BUG reports
   or feature requests
-- [Pull requests](https://github.com/Anselmoo/spectrafit/pulls) for contributing
+- [Pull requests](https://github.com/Anselmoo/SpectraFit/pulls) for contributing
   code
 - Milestones, which are listed below.
 
@@ -124,7 +124,7 @@ The footer should contain any information about **Breaking Changes** and is also
 
 ## Milestones
 
-[Milestones][10] now also available for the `spectrafit` application.
+[Milestones][10] now also available for the `SpectraFit` application.
 Furthermore, project status can be seen in the [GitHub Project Panel][13].
 
 ## Testing
@@ -178,7 +178,7 @@ readability:
 
 This template is adapted from [opengovernment][3].
 
-[1]: https://github.com/Anselmoo/spectrafit/actions
+[1]: https://github.com/Anselmoo/SpectraFit/actions
 [2]: https://google.github.io/styleguide/pyguide.html
 [3]: https://github.com/opengovernment/opengovernment/blob/main/CONTRIBUTING.md
 [4]: https://github.com/astral-sh/uv
@@ -189,9 +189,9 @@ This template is adapted from [opengovernment][3].
 <!-- trunk-ignore(markdownlint/MD053) -->
 
 [8]: https://lmfit.github.io/lmfit-py/fitting.html
-[9]: https://github.com/Anselmoo/spectrafit/pulls
-[10]: https://github.com/Anselmoo/spectrafit/milestones
-[11]: https://github.com/Anselmoo/spectrafit/issues
+[9]: https://github.com/Anselmoo/SpectraFit/pulls
+[10]: https://github.com/Anselmoo/SpectraFit/milestones
+[11]: https://github.com/Anselmoo/SpectraFit/issues
 [12]: https://docs.github.com/en/issues/tracking-your-work-with-issues/linking-a-pull-request-to-an-issue
-[13]: https://github.com/Anselmoo/spectrafit/projects/1
+[13]: https://github.com/Anselmoo/SpectraFit/projects/1
 [14]: https://www.conventionalcommits.org/

README.md

@@ -1,9 +1,9 @@
-[![CI - Python Package](https://github.com/Anselmoo/spectrafit/actions/workflows/python-ci.yml/badge.svg?branch=main)](https://github.com/Anselmoo/spectrafit/actions/workflows/python-ci.yml)
-[![codecov](https://codecov.io/gh/Anselmoo/spectrafit/branch/main/graph/badge.svg?token=pNIMKwWsO2)](https://codecov.io/gh/Anselmoo/spectrafit)
-[![PyPI](https://img.shields.io/pypi/v/spectrafit?logo=PyPi&logoColor=yellow)](https://pypi.org/project/spectrafit/)
+[![CI - Python Package](https://github.com/Anselmoo/SpectraFit/actions/workflows/python-ci.yml/badge.svg?branch=main)](https://github.com/Anselmoo/SpectraFit/actions/workflows/python-ci.yml)
+[![codecov](https://codecov.io/gh/Anselmoo/SpectraFit/branch/main/graph/badge.svg?token=pNIMKwWsO2)](https://codecov.io/gh/Anselmoo/SpectraFit)
+[![PyPI](https://img.shields.io/pypi/v/SpectraFit?logo=PyPi&logoColor=yellow)](https://pypi.org/project/SpectraFit/)
 [![Conda](https://img.shields.io/conda/v/conda-forge/spectrafit?label=Anaconda.org&logo=anaconda)](https://github.com/conda-forge/spectrafit-feedstock)
-[![PyPI - Python Version](https://img.shields.io/pypi/pyversions/spectrafit?color=gree&logo=Python&logoColor=yellow)](https://pypi.org/project/spectrafit/)
-[![pre-commit.ci status](https://results.pre-commit.ci/badge/github/Anselmoo/spectrafit/main.svg)](https://results.pre-commit.ci/latest/github/Anselmoo/spectrafit/main)
+[![PyPI - Python Version](https://img.shields.io/pypi/pyversions/SpectraFit?color=green&logo=Python&logoColor=yellow)](https://pypi.org/project/SpectraFit/)
+[![pre-commit.ci status](https://results.pre-commit.ci/badge/github/Anselmoo/SpectraFit/main.svg)](https://results.pre-commit.ci/latest/github/Anselmoo/SpectraFit/main)
 [![doi](https://img.shields.io/badge/10.1021/acsomega.3c09262-blue?logo=DOI&logoColor=white)](https://pubs.acs.org/doi/full/10.1021/acsomega.3c09262)
 
 <p align="center">
@@ -48,27 +48,27 @@ scientific applications.
 via pip:
 
 ```bash
-pip install spectrafit
+pip install SpectraFit
 
 # with support for Jupyter Notebook
 
-pip install spectrafit[jupyter]
+pip install SpectraFit[jupyter]
 
 # with support for the dashboard in the Jupyter Notebook
 
-pip install spectrafit[jupyter-dash]
+pip install SpectraFit[jupyter-dash]
 
 # with support to visualize pkl-files as graph
 
-pip install spectrafit[graph]
+pip install SpectraFit[graph]
 
 # with all upcomming features
 
-pip install spectrafit[all]
+pip install SpectraFit[all]
 
 # Upgrade
 
-pip install spectrafit --upgrade
+pip install SpectraFit --upgrade
 ```
 
 via conda, see also
@@ -248,7 +248,7 @@ Which results in the following output:
 
 ## Documentation
 
-Please see the [extended documentation](https://anselmoo.github.io/spectrafit/)
+Please see the [extended documentation](https://anselmoo.github.io/SpectraFit/)
 for the full usage of `SpectraFit`.
 
 The documentation is generated by

SECURITY.md

@@ -33,14 +33,14 @@ possible.
 > Current Python vulnerabilities can be found at the [:link:GitHub's Advisory
 > Database][10]. See also: [:link:GitHub's Security Lab][11].
 
-[1]: https://github.com/Anselmoo/spectrafit/
-[2]: https://github.com/Anselmoo/spectrafit/releases
+[1]: https://github.com/Anselmoo/SpectraFit/
+[2]: https://github.com/Anselmoo/SpectraFit/releases
 [3]: https://securitylab.github.com/tools/codeql/
 [4]: https://synk.io/
 [5]: https://sonarcloud.io/
 [6]: https://github.com/dependabot
 [7]: https://pre-commit.com/
 [8]: https://codecov.io/
-[9]: https://github.com/Anselmoo/spectrafit/issues/new/choose
+[9]: https://github.com/Anselmoo/SpectraFit/issues/new/choose
 [10]: https://github.com/advisories?query=type%3Areviewed+ecosystem%3Apip
 [11]: https://securitylab.github.com/