Globally smooth extensions of screened cell representatives #
Small inner bumps remove the retained Coulomb poles. Their transition balls lie strictly outside the associated closed cell, so the extension agrees with the cell representative on a neighborhood of each point of that cell.
Smooth cutoff around a nuclear position for removing its Coulomb singularity.
Equations
Instances For
noncomputable def
LiebThirring.screenedSmoothInverse
(c : Position)
(d : ℝ)
(hd : 0 < d)
(x : Position)
:
A smooth replacement of the inverse distance near a nuclear position.
Equations
- LiebThirring.screenedSmoothInverse c d hd x = (1 - ↑(LiebThirring.screenedInnerBump c d hd) x) * ‖x - c‖⁻¹
Instances For
theorem
LiebThirring.contDiff_screenedSmoothInverse
(c : Position)
(d : ℝ)
(hd : 0 < d)
:
ContDiff ℝ (↑⊤) (screenedSmoothInverse c d hd)
noncomputable def
LiebThirring.screenedCellSmooth
{M : ℕ}
(Z : NNReal)
(R : Fin M → Position)
(hR : Function.Injective R)
(k : Fin M)
(x : Position)
:
Smooth extension of the screened potential from a closed Voronoi cell.
Equations
Instances For
theorem
LiebThirring.contDiff_screenedCellSmooth
{M : ℕ}
(Z : NNReal)
(R : Fin M → Position)
(hR : Function.Injective R)
(k : Fin M)
:
ContDiff ℝ (↑⊤) (screenedCellSmooth Z R hR k)
theorem
LiebThirring.eventuallyEq_screenedCellSmooth
{M : ℕ}
(Z : NNReal)
(R : Fin M → Position)
(hR : Function.Injective R)
(k : Fin M)
{x : Position}
(hx : x ∈ closedVoronoiCell R k)
: