sc::Orbital(3)

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version 2.3.1 · 5 versions
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✨ sc::Orbital(3) ✨

okay so bestie, this is the MPQC manual page for sc::Orbital, and we are gonna get through it together 💖 no cap, every deet is staying right here.

🌸 NAME 🌸

sc::Orbital — literally the subject of this page, the main character of this manual entry 👑

💅 SYNOPSIS 💅

Inherits sc::Volume.

👑 Public Member Functions 👑

  • Orbital (const Ref< KeyVal > &) — a constructor that takes a const Ref< KeyVal > &. That's the whole signature, bestie.
  • Orbital (const Ref< OneBodyWavefunction > &, int orbital) — another constructor, this one takes a const Ref< OneBodyWavefunction > & and an int orbital.
  • virtual void boundingbox (double valuemin, double valuemax, SCVector3 &p1, SCVector3 &p2) — the boundingbox member function signature, with double valuemin, double valuemax, SCVector3 &p1, and SCVector3 &p2. Exact params, no edits 💅

🛡️ Protected Member Functions 🛡️

  • virtual void compute () — Recompute at least the results that have compute true and are not already computed.

🎀 Protected Attributes 🎀

  • Ref< OneBodyWavefunction > wfn_ — a protected attribute named wfn_, typed as Ref< OneBodyWavefunction >.
  • int orbital_ — a protected attribute named orbital_, typed as int.

🌈 Additional Inherited Members 🌈

yep, there are additional inherited members — this page just names the section and moves on, bestie 🦋

🔥 Member Function Documentation 🔥

💜 virtual void sc::Orbital::compute () [protected], [virtual] 💜

Recompute at least the results that have compute true and are not already computed. This should only be called by Result's members.

Implements sc::Volume.

✍️ Author ✍️

Generated automatically by Doxygen for MPQC from the source code.

okay bye bestie 💖 — Version 2.3.1 · Sun Oct 4 2020 · mwah 💋

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