Third-generation muffin-tin orbitals

Bulletin of Materials Science

Volumn 26, Issue 1, 2003, Pages 19-26

  Andersen, O K ^a   Saha Dasgupta, T ^b   Ezhov, S ^a  

^a MAX PLANCK INSTITUT FÜR FESTKÖRPERFORSCHUNG   (Germany)

^b S N BOSE NATIONAL CENTRE FOR BASIC SCIENCES   (India)

Author keywords

Band structure; Density functional; LMTO; Wannier functions

Indexed keywords

BAND STRUCTURE; COMPUTER SIMULATION; ELECTRONIC STRUCTURE; MATHEMATICAL MODELS; PROBABILITY DENSITY FUNCTION;

THIRD GENERATION MUFFIN TIN ORBITALS; WANNIER FUNCTIONS;

MATERIALS SCIENCE;

EID: 0037289436     PISSN: 02504707     EISSN: None     Source Type: Journal    
DOI: 10.1007/BF02712783     Document Type: Article

References (20)

1. Andersen O K and Jepsen O 1984 Phys. Rev. Lett. 53 2571
2. Andersen O K and Saha-Dasgupta T 2000 Phys. Rev. B62 R16219
3. Andersen O K, Postnikov A V and Savrasov S Yu 1992 Applications of multiple scattering theory to materials science, Mat. Res. Soc. Symp. Proc. (eds) W H Butler, P H Dederichs, A Gonis and R L Weaver (Pittsburgh: Materials Research Society) Vol. 253, pp 37-70
4. Andersen O K, Jepsen O and Krier G 1994 Lectures on methods of electronic structure calculations (eds) V Kumar, O K Andersen, and A Mookerjee (Singapore: World Scientific Publishing Co) pp 63-124
5. Andersen O K, Arcangeli C, Tank R W, Saha-Dasgupta T, Krier G, Jepsen O and Dasgupta I 1998 Tight-binding approach to computational materials science, Mat. Res. Soc. Symp. Proc. (eds) L Colombo, A Gonis and P Turchi (Pittsburgh: Materials Research Society) Vol. 491, pp 3-34
6. Andersen O K, Saha-Dasgupta T, Tank R W, Arcangeli C, Jepsen O and Krier G 2000 Electronic structure and physical properties of solids. The uses of the LMTO method (ed.) H Dreysse (New York: Springer Lecture Notes in Physics) pp 3-84
7. Arcangeli C and Andersen O K, to be published
8. Dasgupta I et al, to be published
9. Dasgupta I, Saha-Dasgupta T, Andersen O K, Pavarini E and Jepsen O to be published
10. Hubbard J 1967 Proc. Phys. Soc. London 91 921 and references therein
11. Kohn W and Rostoker J 1954 Phys. Rev. 94 111
12. Korotin M A, Anisimov V I, Saha-Dasgupta T and Dasgupta I 2000 J. Phys. Cond. Matter 12 113
13. Korringa J 1947 Physica 13 392
14. Müller T F A, Anisimov V, Rice T M, Dasgupta I and Saha-Dasgupta T 1998 Phys. Rev. B57 R12655
15. Pavarini E, Dasgupta I, Saha-Dasgupta T, Jepsen O and Andersen O K 2001 Phys. Rev. Lett. 87 047003
16. Sarma D D, Mahadevan P, Saha-Dasgupta T, Ray S and Kumar A 2000 Phys. Rev. Lett. 85 2549
17. Savrasov D and Andersen O K to be published
18. Tank R W and Arcangeli C 2000 Phys. Status Solidi (b)217 89
19. Valenti R Saha-Dasgupta T, Alvarez J V, Pozgajcic K and Gros C 2001 Phys. Rev. Lett. 86 5381
20. Zeller R, Dederichs P H, Ujfalussy B, Szunyogh L and Weinberger P 1995 Phys. Rev. B52 8807