Namespace ScineΒΆ
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namespace
Scine
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namespace
Readuct
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class
IRCTask
: public Scine::Readuct::Task - #include <IRCTask.h>
A task to run an IRC optimization using a given normal mode.
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class
Task
- #include <Task.h>
The base class for all tasks in Readuct.
Subclassed by Scine::Readuct::AFIROptimizationTask, Scine::Readuct::GeometryOptimizationTask, Scine::Readuct::HessianTask, Scine::Readuct::IRCTask, Scine::Readuct::SinglePointTask, Scine::Readuct::TSOptimizationTask
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class
TaskFactory
- #include <TaskFactory.h>
A factory generating Tasks by name (mainly).
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class
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namespace