Full-potential electronic structure method. Energy and force calculations with density functional and dynamical mean field theory
DOI10.1007/978-3-642-15144-6zbMATH Open1217.74003OpenAlexW1623179375MaRDI QIDQ992768FDOQ992768
Authors: J. Martínez 
Publication date: 10 September 2010
Published in: Springer Series in Solid-State Sciences (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1007/978-3-642-15144-6
Recommendations
semiconductorsmagnetismchemical bindinglinear muffin-tin orbital methodrelativistic spin-polarized test
Molecular, statistical, and kinetic theories in solid mechanics (74A25) Statistical mechanics of solids (82D20) Statistical mechanics of metals (82D35) Research exposition (monographs, survey articles) pertaining to mechanics of deformable solids (74-02)
Cited In (11)
- Pulay forces in density functional theory for periodic and molecular systems
- A mathematical introduction to electronic structure theory
- The embedding method for electronic structure
- Band structure of cubic hydrides
- Quantal Density Functional Theory II
- RSPt
- Electronic Structure
- Electronic structure calculations of solids using the WIEN2k package for material sciences
- Completely soft molecular electrostatic potentials (CoSMEP) and total density functions
- Transparent boundary conditions for higher-order finite-difference schemes of the Schrödinger equation in (1+1)D
- ComDMFT: a massively parallel computer package for the electronic structure of correlated-electron systems
Uses Software
This page was built for publication: Full-potential electronic structure method. Energy and force calculations with density functional and dynamical mean field theory
Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q992768)
