Comparative Hartree-Fock and density-functional theory study of cubic and hexagonal diamond
Author:
Affiliation:
1. a Department of Applied Physics , Royal Melbourne Institute of Technology University , GPO Box 2476V, Melbourne , 3001 , Australia
Publisher
Informa UK Limited
Subject
General Physics and Astronomy,General Chemical Engineering
Link
https://www.tandfonline.com/doi/pdf/10.1080/13642810208222938
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1. Development of an improved Stillinger-Weber potential for tetrahedral carbon usingab initio(Hartree-Fock and MP2) methods
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4. The Band Structure of Diamond
5. Static lattice and electron properties ofMgCO3(magnesite) calculated byab initioperiodic Hartree-Fock methods
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