Mauri F - Search Results

1

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials.

Giannozzi P, Baroni S, Bonini N, Calandra M, Car R, Cavazzoni C, Ceresoli D, Chiarotti GL, Cococcioni M, Dabo I, Dal Corso A, de Gironcoli S, Fabris S, Fratesi G, Gebauer R, Gerstmann U, Gougoussis C, Kokalj A, Lazzeri M, Martin-Samos L, Marzari N, Mauri F, Mazzarello R, Paolini S, Pasquarello A, Paulatto L, Sbraccia C, Scandolo S, Sclauzero G, Seitsonen AP, Smogunov A, Umari P, Wentzcovitch RM. Giannozzi P, et al. Among authors: mauri f. J Phys Condens Matter. 2009 Sep 30;21(39):395502. doi: 10.1088/0953-8984/21/39/395502. Epub 2009 Sep 1. J Phys Condens Matter. 2009. PMID: 21832390

2

Acceleration schemes for ab initio molecular-dynamics simulations and electronic-structure calculations.

Tassone F, Mauri F, Car R. Tassone F, et al. Among authors: mauri f. Phys Rev B Condens Matter. 1994 Oct 15;50(15):10561-10573. doi: 10.1103/physrevb.50.10561. Phys Rev B Condens Matter. 1994. PMID: 9975153 No abstract available.

3

Orbital formulation for electronic-structure calculations with linear system-size scaling.

Mauri F, Galli G, Car R. Mauri F, et al. Phys Rev B Condens Matter. 1993 Apr 15;47(15):9973-9976. doi: 10.1103/physrevb.47.9973. Phys Rev B Condens Matter. 1993. PMID: 10005088 No abstract available.

4

First-principles study of excitonic self-trapping in diamond.

Mauri F, Car R. Mauri F, et al. Phys Rev Lett. 1995 Oct 23;75(17):3166-3169. doi: 10.1103/PhysRevLett.75.3166. Phys Rev Lett. 1995. PMID: 10059511 No abstract available.

5

First-principles calculation of vibrational Raman spectra in large systems: signature of small rings in crystalline SiO2.

Lazzeri M, Mauri F. Lazzeri M, et al. Among authors: mauri f. Phys Rev Lett. 2003 Jan 24;90(3):036401. doi: 10.1103/PhysRevLett.90.036401. Epub 2003 Jan 23. Phys Rev Lett. 2003. PMID: 12570512

6

Electronic-enthalpy functional for finite systems under pressure.

Cococcioni M, Mauri F, Ceder G, Marzari N. Cococcioni M, et al. Among authors: mauri f. Phys Rev Lett. 2005 Apr 15;94(14):145501. doi: 10.1103/PhysRevLett.94.145501. Epub 2005 Apr 11. Phys Rev Lett. 2005. PMID: 15904072

7

Theoretical explanation of superconductivity in C6Ca.

Calandra M, Mauri F. Calandra M, et al. Among authors: mauri f. Phys Rev Lett. 2005 Dec 2;95(23):237002. doi: 10.1103/PhysRevLett.95.237002. Epub 2005 Nov 30. Phys Rev Lett. 2005. PMID: 16384331

8

Nonadiabatic Kohn anomaly in a doped graphene monolayer.

Lazzeri M, Mauri F. Lazzeri M, et al. Among authors: mauri f. Phys Rev Lett. 2006 Dec 31;97(26):266407. doi: 10.1103/PhysRevLett.97.266407. Epub 2006 Dec 29. Phys Rev Lett. 2006. PMID: 17280442

9

Phonon anharmonicities in graphite and graphene.

Bonini N, Lazzeri M, Marzari N, Mauri F. Bonini N, et al. Among authors: mauri f. Phys Rev Lett. 2007 Oct 26;99(17):176802. doi: 10.1103/PhysRevLett.99.176802. Epub 2007 Oct 24. Phys Rev Lett. 2007. PMID: 17995357

10

Giant nonadiabatic effects in layer metals: raman spectra of intercalated graphite explained.

Saitta AM, Lazzeri M, Calandra M, Mauri F. Saitta AM, et al. Among authors: mauri f. Phys Rev Lett. 2008 Jun 6;100(22):226401. doi: 10.1103/PhysRevLett.100.226401. Epub 2008 Jun 2. Phys Rev Lett. 2008. PMID: 18643433

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