sc::PsiInput(3)

💅 sc::PsiInput(3) — like, the whole manual, bestie

okay so real talk — this is from the MPQC manual (section 3, the library-functions girlies), and today's main character is sc::PsiInput. Periodt.

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✨ NAME ✨

sc::PsiInput — PsiInput is a Psi input file. That's it, that's the whole vibe. It's a Psi input file. 🎀

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🌸 SYNOPSIS 🌸

#include <psiinput.h>

Bestie, she Inherits sc::RefCount — so she's reference-counted, she's got that shared-ownership energy, she's not out here leaking. 💅

🦋 Public Member Functions

• PsiInput (const string &name)
• void open ()
• void close ()
• void print (std::ostream &)
• void begin_section (const char *s)
• void end_section ()
• void write_indent ()
• void incindent (int)
• void decindent (int)
• void write_comment (const char *)
• void write_keyword (const char *, const char *)
• void write_keyword (const char *, int)
• void write_keyword (const char *, double)
• void write_keyword_array (const char *, int, int *)
• void write_keyword_array (const char *, int, double *)
• void write_string (const char *)
• void write_key_wq (const char *, const char *)
• void write_basis (const Ref< GaussianBasisSet > &)
  • Construct the 'basis' keyword for input. 🫶
• void write_basis_sets (const Ref< GaussianBasisSet > &)
  • Write basis sets explicitly. No shortcuts, we're spelling it all out.
• void write_geom (const Ref< Molecule > &)
• void write_defaults (const Ref< PsiExEnv > &, const char *dertype)

ngl the overloaded write_keyword trio and the write_keyword_array duo are giving "I contain multitudes" — same name, different types, and we stan a flexible icon. ✨

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🧚 Additional Inherited Members

yep, she's got extras she got from her parent sc::RefCount — not listed here, but they're real and they're hers. 💜

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👑 Detailed Description

PsiInput is a Psi input file. 😭 That's the entire detailed description, bestie — sometimes the documentation is just a mood and honestly? Iconic of it. Literally the same sentence as NAME. We love a consistent queen.

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🍓 Author

Generated automatically by Doxygen for MPQC from the source code. So nobody hand-wrote this — it's the robot's work, and the robot said what it said. 🤖💀

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and that's the whole page, bestie — every single function, every argument, nothing skipped, no cap. 🌈✨

🌸 version 2.3.1, dated Sun Oct 4 2020, and it's sc::PsiInput(3) all the way down — mwah 💋🫶