DevelopmentΒΆ
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Development topics:
- How to contribute
- Coding Conventions
- Writing documentation
- Adding new calculators
- Description of base-classes
- The Calculator base-class
Calculator
Calculator.default_parameters
Calculator.ignored_changes
Calculator.discard_results_on_any_change
Calculator.set_label()
Calculator.reset()
Calculator.read()
Calculator.set()
Calculator.check_state()
Calculator.calculate()
Calculator.calculate_numerical_forces()
Calculator.calculate_numerical_stress()
Calculator.band_structure()
- The FileIOCalculator class
- The Calculator base-class
- Description of base-classes
- Making movies
- New release
- Testing the code
- Bugs!
- License
- Translate ASE
- ASE enhancement proposals