Ectoolkits

<!-- Release notes generated using configuration in .github/release.yml at main -->

What's Changed
New Features
* Reweight prop by robinzyb in https://github.com/robinzyb/ECToolkits/pull/46
Other Changes
* Fix typo by robinzyb in https://github.com/robinzyb/ECToolkits/pull/45


**Full Changelog**: https://github.com/robinzyb/ECToolkits/compare/v0.4.1...v0.4.2

<!-- Release notes generated using configuration in .github/release.yml at main -->

What's Changed
New Features
* add plot_model_devi for ploting model deivation files together by robinzyb in https://github.com/robinzyb/ECToolkits/pull/42
* A new class for calculating Proton Transfer CV by robinzyb in https://github.com/robinzyb/ECToolkits/pull/44
Enhancements
* change arg name for consistency by robinzyb in https://github.com/robinzyb/ECToolkits/pull/43
Other Changes
* add documentation for development and todo list by robinzyb in https://github.com/robinzyb/ECToolkits/pull/41


**Full Changelog**: https://github.com/robinzyb/ECToolkits/compare/v0.3.1...v0.4.1

<!-- Release notes generated using configuration in .github/release.yml at main -->

What's Changed
New Features
* Water dipole analysis by lucasdekam in https://github.com/robinzyb/ECToolkits/pull/36
* Construct free energy surfaces through reweighting by robinzyb in https://github.com/robinzyb/ECToolkits/pull/40
Enhancements
* add merged frc comp in dptest plot by robinzyb in https://github.com/robinzyb/ECToolkits/pull/38
Other Changes
* Modify the doc for atom density analysis by robinzyb in https://github.com/robinzyb/ECToolkits/pull/37

New Contributors
* lucasdekam made their first contribution in https://github.com/robinzyb/ECToolkits/pull/36

**Full Changelog**: https://github.com/robinzyb/ECToolkits/compare/v0.2.6...v0.3.1

<!-- Release notes generated using configuration in .github/release.yml at main -->

What's Changed
New Features
* Add the plot function for dptest by robinzyb in https://github.com/robinzyb/ECToolkits/pull/35
Enhancements
* move to codecov action and update special case for atomic density in 2D materials by robinzyb in https://github.com/robinzyb/ECToolkits/pull/30
* add badges by robinzyb in https://github.com/robinzyb/ECToolkits/pull/31
Bug Fixes
* fix rutile 1p11 edge structure parser by robinzyb in https://github.com/robinzyb/ECToolkits/pull/26
* update get_rotM_edged_rutile110. adhoc but fix 16 water failures. by ruihao99 in https://github.com/robinzyb/ECToolkits/pull/27
* Fix typo of indices, Fix bug for parse edge models by robinzyb in https://github.com/robinzyb/ECToolkits/pull/29
* wrap the surface z postiions to the first frame by robinzyb in https://github.com/robinzyb/ECToolkits/pull/33
Other Changes
* Patch for Rutile1p11Edge: robustness improvement by ruihao99 in https://github.com/robinzyb/ECToolkits/pull/25
* Fix typo and improve algorithms by ruihao99 in https://github.com/robinzyb/ECToolkits/pull/28
* add pytest for atom density analysis by robinzyb in https://github.com/robinzyb/ECToolkits/pull/32
* update the doc for atomdensity analysis by robinzyb in https://github.com/robinzyb/ECToolkits/pull/34


**Full Changelog**: https://github.com/robinzyb/ECToolkits/compare/v0.2.5...v0.2.6

<!-- Release notes generated using configuration in .github/release.yml at main -->

What's Changed
Enhancements
* add CI, release and pub-pypi workflow files by robinzyb in https://github.com/robinzyb/ECToolkits/pull/24
Bug Fixes
* fix bug for pytest. by robinzyb in https://github.com/robinzyb/ECToolkits/pull/23
Other Changes
* Fix bug for range selection by robinzyb in https://github.com/robinzyb/ECToolkits/pull/1
* fix typo by robinzyb in https://github.com/robinzyb/ECToolkits/pull/2
* fix typo by robinzyb in https://github.com/robinzyb/ECToolkits/pull/3
* add atom density analysis by robinzyb in https://github.com/robinzyb/ECToolkits/pull/4
* add density plot and average density by robinzyb in https://github.com/robinzyb/ECToolkits/pull/5
* Add methods for rutile (110) by ruihao69 in https://github.com/robinzyb/ECToolkits/pull/6
* version update by robinzyb in https://github.com/robinzyb/ECToolkits/pull/7
* Devel by robinzyb in https://github.com/robinzyb/ECToolkits/pull/8
* Devel by robinzyb in https://github.com/robinzyb/ECToolkits/pull/9
* Create LICENSE by robinzyb in https://github.com/robinzyb/ECToolkits/pull/10
* implementing dissociation degree analysis method by appassionate in https://github.com/robinzyb/ECToolkits/pull/12
* Devel by robinzyb in https://github.com/robinzyb/ECToolkits/pull/13
* Devel by robinzyb in https://github.com/robinzyb/ECToolkits/pull/14
* Update doc using jp-book by robinzyb in https://github.com/robinzyb/ECToolkits/pull/15
* New Features: add cli tools and fix bugs for band_align by robinzyb in https://github.com/robinzyb/ECToolkits/pull/16
* New Feature: workflows for calculate dielectric constant by robinzyb in https://github.com/robinzyb/ECToolkits/pull/17
* New Feature: workflow for calculating dielectric constant by robinzyb in https://github.com/robinzyb/ECToolkits/pull/18
* Finished the documentation of workflow by robinzyb in https://github.com/robinzyb/ECToolkits/pull/19
* merge to main by robinzyb in https://github.com/robinzyb/ECToolkits/pull/20
* Devel by robinzyb in https://github.com/robinzyb/ECToolkits/pull/22
* Fix rutile1p11 edge utilities by ruihao69 in https://github.com/robinzyb/ECToolkits/pull/21

New Contributors
* robinzyb made their first contribution in https://github.com/robinzyb/ECToolkits/pull/1
* ruihao69 made their first contribution in https://github.com/robinzyb/ECToolkits/pull/6
* appassionate made their first contribution in https://github.com/robinzyb/ECToolkits/pull/12

**Full Changelog**: https://github.com/robinzyb/ECToolkits/commits/v0.2.5