102 entries « 4 of 6 »

Tiago, M L; Kent, P R C; Hood, R Q; Reboredo, F A

Neutral and charged excitations in carbon fullerenes from first-principles many-body theories (Journal Article)

In: The Journal of Chemical Physics, vol. 129, pp. 084311, 2008.

(BibTeX)

Sai, N; Tiago, M L; Chelikowsky, J R; Reboredo, F A

Optical spectra and exchange-correlation effects in molecular crystals (Journal Article)

In: Physical Review B, vol. 77, pp. 161306, 2008.

(BibTeX)

del Puerto, Lopez M; Tiago, M L; Chelikowsky, J R

Ab initio methods for the optical properties of CdSe clusters (Journal Article)

In: Physical Review B, vol. 77, pp. 045404, 2008.

(BibTeX)

Han, J; Tiago, M L; Chan, T -L; Chelikowsky, J R

Real-Space First-Principles Method for the Electronic Structure of One Dimensional Periodic Systems (Journal Article)

In: J. Chem. Phys., vol. 129, pp. 144109, 2008.

(BibTeX)

Natan, A; Mor, A; Naveh, D; Kronik, L; Tiago, M L; Beckman, S P; Chelikowsky, J R

Real-space pseudopotential method for first principles calculations of general periodic and partially periodic systems (Journal Article)

In: Phys. Rev. B, vol. 78, pp. 075109, 2008.

(BibTeX)

Kwak, H; Tiago, M L; Chan, T -L; Chelikowsky, J R

Hyperfine splitting of partially ionized Li donors in ZnO nanocrystals (Journal Article)

In: Chem. Phys. Lett., vol. 454, pp. 337, 2008.

(BibTeX)

Zayak, A T; Entel, P; Chelikowsky, J R

Minority spin polarization and surface magnetic enhancement in Heusler clusters (Journal Article)

In: Phys. Rev. B, vol. 77, pp. 212401, 2008.

(BibTeX)

Alemany, M M G; Huang, X; Tiago, M L; Gallego, L J; Chelikowsky, J R

Ab initio calculations for p-type doped bulk indium phosphide (Journal Article)

In: Solid State Commun., vol. 146, pp. 245, 2008.

(BibTeX)

Zayak, A T; Beckman, S; Tiago, M; Entel, P; Chelikowsky, J R

Switchable Heusler Clusters (Journal Article)

In: J. Appl. Phys., vol. 104, pp. 074307, 2008.

(BibTeX)

Kong, L; Chelikowsky, J R

Transport properties of transition-metal-encapsulated Si cages (Journal Article)

In: Phys. Rev. B, vol. 77, pp. 073401, 2008.

(BibTeX)

Chan, T -L; Tiago, M L; Kaxiras, E; Chelikowsky, J R

Size Limits on Doping Phosphorus into Silicon Nanocrystals (Journal Article)

In: Nano Letters, vol. 8, pp. 596, 2008.

(BibTeX)

Kwak, H; Tiago, M L; Chelikowsky, J R

Quantum Confinement and Strong Coulombic Correlation in ZnO Nanocrystals (Journal Article)

In: Solid State Commun., vol. 145, pp. 227, 2008.

(BibTeX)

Alemany, M M G; Tortajada, L; Huang, X; Tiago, M L; Gallego, L J; Chelikowsky, J R

The role of dimensionality and quantum confinement in p-type semiconductor indium phosphide nanomaterials (Journal Article)

In: Phys. Rev. B, vol. 78, pp. 233101, 2008.

(BibTeX)

Kwak, H; Tiago, M L; Chan, T -L; Chelikowsky, J R

The Role of Quantum Confinement and Hyperfine Splitting in Li Doped ZnO Nanocrystals (Journal Article)

In: Phys. Rev. B, vol. 78, pp. 195324, 2008.

(BibTeX)

Natan, A; Benjamini, A; Naveh, D; Kronik, L; Tiago, M L; Beckman, S P; Chelikowsky, J R

Real-space pseudopotential method for first principles calculations of general periodic and partially periodic systems (Journal Article)

In: Phys. Rev. B, vol. 78, pp. 075109, 2008.

(BibTeX)

Guliamov, O; Kronik, L; Martin, J M L

Polarizability of small carbon cluster anions from first principles (Journal Article)

In: J. Phys. Chem., vol. A 111, pp. 2028, 2007.

(BibTeX)

Naveh, D; Kronik, L; Tiago, M L; Chelikowsky, J R

Real-Space Pseudopotential method for Spin-Orbit Coupling within Density Functional Theory (Journal Article)

In: Phys. Rev. B, vol. 76, pp. 153407, 2007.

(BibTeX)

Sitt, A; Kronik, L; Ismail-Beigi, S; Chelikowsky, J R

Excited state forces within time-dependent density functional theory: a frequency domain approach (Journal Article)

In: Phys. Rev. A, vol. 76, pp. 054501, 2007.

(BibTeX)

Tiago, M L; Chelikowsky, J R

Optical excitations in organic molecules, clusters, and defects studied by first-principles Green's function methods (Journal Article)

In: Physical Review B, vol. 73, pp. 205334, 2006.

(BibTeX)

del Puerto, M; Tiago, M L; Chelikowsky, J R

Excitonic Effects and Optical Properties of Passivated CdSe Clusters (Journal Article)

In: Physical Review Letters, vol. 97, pp. 096401, 2006.

(BibTeX)

102 entries « 4 of 6 »