Three real-space discretization techniques in electronic structure calculations

Details Three real-space discretization techniques in electronic structure calculations Three real-space discretization techniques in electronic structure calculations

2006-01-10

arxiv.org/abs/cond-mat/0601201v2

Physics

Condensed Matter

Materials Science

39 pages, 10 figures, accepted to a special issue of "physica status solidi (b) - basic solid state physics" devoted to the CE

Scientific paper

10.1002/pssb.200541348

A characteristic feature of the state-of-the-art of real-space methods in electronic structure calculations is the diversity of the techniques used in the discretization of the relevant partial differential equations. In this context, the main approaches include finite-difference methods, various types of finite-elements and wavelets. This paper reports on the results of several code development projects that approach problems related to the electronic structure using these three different discretization methods. We review the ideas behind these methods, give examples of their applications, and discuss their similarities and differences.

Affiliated with

Also associated with

No associations

Rating

Three real-space discretization techniques in electronic structure calculations does not yet have a rating. At this time, there are no reviews or comments for this scientific paper.

If you have personal experience with Three real-space discretization techniques in electronic structure calculations, we encourage you to share that experience with our LandOfFree.com community. Your opinion is very important and Three real-space discretization techniques in electronic structure calculations will most certainly appreciate the feedback.

Rate now

Comments { 0 }

Profile ID: LFWR-SCP-O-215183