17 results on '"Gonze, X."'
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2. Recent developments in the ABINIT software package
3. Computed electronic and optical properties of SnO2 under compressive stress
4. First-principles characterization of the electronic and optical properties of hexagonal [formula omitted]
5. Verification of first-principles codes: Comparison of total energies, phonon frequencies, electron–phonon coupling and zero-point motion correction to the gap between ABINIT and QE/Yambo
6. First-principles and experimental characterization of the electronic and optical properties of CaS and CaO
7. Finite homogeneous electric fields in the projector augmented wave formalism: Applications to linear and nonlinear response
8. Wannier functions approach to van der Waals interactions in ABINIT
9. ABINIT: First-principles approach to material and nanosystem properties
10. Specification of an extensible and portable file format for electronic structure and crystallographic data
11. Sharing electronic structure and crystallographic data with ETSF_IO
12. Modeling the dissociation and ionization of a sputtered organic molecule
13. Mechanism of metal cationization in organic SIMS
14. The formation of singly and doubly cationized oligomers in SIMS
15. Single and double cationization of organic molecules in SIMS
16. First-principles computation of material properties: the ABINIT software project
17. Mechanism of metal cationization in organic SIMS
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