4.7 Article

A method of calculating bandstructure in real-space with application to all-electron and full potential

相关参考文献

注意:仅列出部分参考文献,下载原文获取全部文献信息。
Article Mathematics, Applied

Numerical quadrature in the Brillouin zone for periodic Schrodinger operators

Eric Cances et al.

NUMERISCHE MATHEMATIK (2020)

Article Nanoscience & Nanotechnology

From Fundamental First-Principle Calculations to Nanoengineering Applications: A Review of the NESSIE Project

James Kestyn et al.

IEEE NANOTECHNOLOGY MAGAZINE (2020)

Article Materials Science, Multidisciplinary

Theory of ionization potentials of nonmetallic solids

Yu Kumagai et al.

PHYSICAL REVIEW B (2017)

Article Mathematics, Applied

ON THE CRYSTAL GROUND STATE IN THE SCHRODINGER-POISSON MODEL

A. I. Komech

SIAM JOURNAL ON MATHEMATICAL ANALYSIS (2015)

Article Computer Science, Interdisciplinary Applications

FEAST fundamental framework for electronic structure calculations: Reformulation and solution of the muffin-tin problem

Alan R. Levin et al.

COMPUTER PHYSICS COMMUNICATIONS (2012)

Article Materials Science, Multidisciplinary

Density-matrix-based algorithm for solving eigenvalue problems

Eric Polizzi

PHYSICAL REVIEW B (2009)

Review Materials Science, Multidisciplinary

Finite element methods in ab initio electronic structure calculations

JE Pask et al.

MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING (2005)