Paper detail

Shannon entropy in confined He-like ions within a density functional formalism

Shannon entropy in position ($S_{\rvec}$) and momentum ($S_{\pvec}$) spaces, along with their sum ($S_t$) are presented for unit-normalized densities of He, Li$^+$ and Be$^{2+}$ ions, spatially confined at the center of an impenetrable spherical enclosure defined by a radius $r_c$. Both ground as well as some selected low-lying singly excited states, \emph{viz.,} 1sns (n $=$ 2-4) $^3$S, 1snp (n $=$ 2-3) $^3$P, 1s3d $^3$D are considered within a density functional methodology that makes use of a work-function-based exchange potential along with two correlation potentials (local Wigner-type parametrized functional as well as the more involved non-linear gradient- and Laplacian-dependent Lee-Yang-Parr functional). The radial Kohn-Sham (KS) equation is solved using an optimal spatial discretization scheme via the generalized pseudospectral (GPS) method. A detailed systematic analysis of the confined system (relative to corresponding free system) has been performed for these quantities with respect to $r_c$ in tabular and graphical forms, \emph{with and without} electron correlation. Due to compression, the pattern of entropy in aforementioned states gets characterized by various crossovers at intermediate and lower $r_c$ regions. The impact of electron correlation is more pronounced in weaker confinement limit, and appears to decay with rise in confinement strength. The exchange-only results are quite good to provide a decent qualitative discussion. The lower-bounds provided by entropic uncertainty relation holds good in all cases. Several other new interesting features are observed.

preprint2021arXivOpen access

Signal facts

What is known right now

Open access2 authors1 topic

Next steps

Decide what to do with this paper

Use like or dislike for the fast social read. The more specific scholarly feedback stays available below when needed.

Log in to curate

Reading frame

Keep the important context close to the paper

Keep the important signals around this paper in one place: votes, save state, collection context, reviews and the metadata you need before deciding what to do next.

Institutions

Add specific reaction

Move through the context

Research map

Open full explorer

Move through nearby people, institutions, topics and adjacent work without leaving the paper page.

Building this map preview

BZPEER is loading the nearby papers, people, topics and institutions for this page.

Structured reviews

0 review(s)

ContributeLeave structured feedbackUse the review template when you have a concrete strength, concern or method question.Open review form

No structured reviews yet. High-signal critique starts here.

Work discussion

0 comment(s)

DiscussAdd a high-signal commentKeep quick notes, caveats and replication pointers separate from formal reviews.Open comment form

No discussion yet. The first strong comment sets the tone.