Further developments in the local-orbital density-functional-theory tight-binding method
Article
Lewis, James P., Glaesemann, Kurt R.
, Voth, Gregory A., Fritsch, Jürgen, Demkov, Alexander A., Ortega, José and Sankey, Otto F.
(2001)
Further developments in the local-orbital density-functional-theory tight-binding method.
Physical Review B 64 (19).
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| Item type | Article | ||||
| Journal or Publication Title | Physical Review B | ||||
| Publisher | AMER PHYSICAL SOC | ||||
| Place of Publication | COLLEGE PK | ||||
| Volume | 64 | ||||
| Number of Issue or Book Chapter | 19 | ||||
| Date | 2001 | ||||
| Date of publication | 19 Dec 2024 15:49 | ||||
| Institutions | Physics > Institute of Theroretical Physics | ||||
| Identification Number |
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| Keywords | GENERALIZED GRADIENT APPROXIMATION; NORM-CONSERVING PSEUDOPOTENTIALS; MOLECULAR-DYNAMICS SIMULATIONS; HYDROGEN-BONDED SYSTEMS; III-V NITRIDES; ELECTRONIC-STRUCTURE; EXTREMAL PROPERTIES; CORRELATION-ENERGY; GROUND-STATE; BASIS-SETS; | ||||
| Dewey Decimal Classification | 500 Science > 530 Physics | ||||
| Status | Published | ||||
| Refereed | Yes, this version has been refereed | ||||
| Created at the University of Regensburg | Yes | ||||
| Item ID | 73338 |
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