Scine::Sparrow  5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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OrderedInput.h File Reference
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Classes

struct  Scine::Sparrow::detail::RestrictedBase
 Result of the pruning procedure. Restricted specialization. Note: all quantities are sorted in increasing energy order. More...
 
struct  Scine::Sparrow::detail::UnrestrictedBase
 Result of the pruning procedure. Unrestricted specialization. Has an additional "isBeta" bool vector. Note: all quantities are sorted in increasing energy order. More...
 
class  Scine::Sparrow::OrderedInput< restrictedness >
 Ordered input for the TDDFTB eigenvalue solver. Contains quantities in increasing energetic order. More...
 

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