Professur für Opto- und Festkörperelektronik






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Dr. Alberto Martinez-Limia

 
Contact Address
Technische Universität Chemnitz
A.-F.-Weinhold-Bau, Zimmer 528A
Reichenhainer Straße 70
D-09126 Chemnitz 		Telefon: +49 (0)371-531 2554
Telefax: +49 (0)371-531 3004
E-Mail:  martinez@hrz.tu-chemnitz.de
 
Research Interests
  • Modelling of materials, interfaces and nanostructures with technological interest
  • Structural and electronic properties
  • Thermal stability
  • Dynamical behaviour and fabrication and degradation processes
  • Combination of complementary methods for modelling with different accuracy and on different time scales
 
Research Methods
  • Ab initio electronic structure methods
  • Car-Parrinello Molecular Dynamics
  • Classical Monte Carlo simulations
  • Classical Molecular Dynamics
 
Publications
Structural and electronic properties of dangling bonds free nitridated Silicon Dioxide, P. Plänitz, A. Martinez-Limia, C. Radehaus, in preparation

Understanding catalysed growth of single-wall carbon nanotubes, J. Zhao, A. Martinez-Limia, and P. B. Balbuena, Nanotechnology, 16, S575–S581, (2005)

Crystalline structure and lithium-ion channel formation in self assembled di-lithium phthalocyanine, Y. Zhang, P. R. Alonso, A. Martinez-Limia, L. G. Scanlon, and P. Balbuena, J. Phys. Chem. B, 108, 4659-4668, (2004)

Effect of static electric field on the HF band structure of a guanine stack, A. Martinez; F. Bogar, P. Otto, and J. Ladik, Int. J. Quantum Chem., 99, 833-840 (2004)

Dynamic (hyper)polarizability calculations for polymers with linear and cyclic pi-conjugated elementary cells, P. Otto, M. Piris, A. Martinez, and J. Ladik, Synthetic Metals, 141 ,277-280, (2004)

Natural orbital functional approach: Calculation of dielectric properties in molecules, M. Piris, A. Martinez, and P. Otto, Int. J. Quantum Chem., 97, 827-831, (2004)

A note on the mechanism of charge transport at different temperatures in aperiodic nucleotide base stacks, J. Cizek, A. Martinez and J. Ladik, J. Mol. Struct. (Theochem), 626, 77-80, (2003)

Coupled-perturbed Hartree-Fock theory for quasi-one dimensional periodic systems: Calculation of static and dynamic nonlinear optical properties of model systems, A. Martinez, P.Otto, and J. Ladik, Int. J. Quantum Chem., 94, 251-268 (2003)

Frequency dependent nonlinear optical properties of molecules: Alternative solution of the coupled perturbed Hartree-Fock equations, A. Martinez, A. Czaja, P.Otto, and J. Ladik, J. Mol. Struct. (Theochem), 589-590, 349, (2002)

Electron correlation corrected static polarizabilities of polymers with linear and cyclic conjugated elementary cells, P.Otto, A. Martinez, A. Czaja, and J. Ladik, J. Chem. Phys., 117, 1908, (2002)

Nonlinear optical properties of quasi-one-dimensional periodic systems: consistent theoretical treatment within the crystal orbital method, A. Martinez, Chem. Phys. Lett., 327, 389, (2000)

Calculated state densities of aperiodic nucleotide base stacks, Y.-J. Ye, R.-S.Chen, A. Martinez, P. Otto and J. Ladik, Physica B, 279, 246, (2000)

Calculation of static vibrational polarizabilities of polymers: Poly(HF) in two configurations, P.Otto, A. Martinez and J. Ladik, J. Chem. Phys., 111, 6100, (1999)

Calculation of hopping conductivity in aperiodic nucleotide base stacks, Y.-J. Ye, R.-S.Chen, A. Martinez, P. Otto and J. Ladik, Solid State Comm., 112, 139, (1999)

Irradiation effects of Co-60 gamma rays in YBCO thick films, A. Leyva; M. Mora, G. Martin and A. Martinez, Supercond. Sci. Technol., 8, 816, (1995)