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Keyword [electronic structure calculations]
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1. First-principles Studies On Electronic Structures Of Compounds Containing Local D/f Electrons
2. Theoretical Research On Performance Regulation Of New Two-dimensional Group-? Monochalcogenides Materials
3. Multi-million atom electronic structure calculations for quantum dots
4. Hartree-Fock electronic structure calculations for free atoms and immersed atoms in an electron gas
5. X-ray diffraction-based electronic structure calculations and experimental x-ray analysis for medical and materials applications
6. Electronic structure and magnetism in some transition metal nitrides: Manganese-doped scandium nitride, dilute magnetic semiconductor and chromium nitride, Mott insulator
7. The reduced density matrix method for electronic structure calculations: Application of semidefinite programming to N-fermion systems
8. Electronic structure calculations of group III nitride clusters
9. A comparison of linear scaling replacements for diagonalization in electronic structure calculations
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