Man

Eduardo Ariel Menendez Proupin

Associate Professor

DPTO DE FISICA, FACULTAD DE CIENCIAS, UNIVERSIDAD DE CHILE

Santiago, Chile

Líneas de Investigación


Computational Materials Science; Chemical Physics

Educación

  •  Physics, UNIVERSIDAD DE LA HABANA. Cuba, 2001
  •  Physics, UNIVERSIDAD DE LA HABANA. Cuba, 1995
  •  Physics, UNIVERSIDAD DE LA HABANA. Cuba, 1997

Experiencia Académica

  •   Associate Instructor Part Time

    PONTIFICIA UNIVERSIDAD CATOLICA DE CHILE

    Faculty of Physics

    Santiago, Chile

    2003 - 2004

  •   Assistant Professor Full Time

    UNIVERSIDAD DE CHILE

    Faculty of Science

    Santiago, Chile

    2004 - 2012

  •   Associate Professor Full Time

    UNIVERSIDAD DE CHILE

    Faculty of Science

    Santiago, Chile

    2012 - At present

  •   Instructor Full Time

    UNIVERSIDAD DE LA HABANA

    Faculty of Physics

    La Habana, Cuba

    1995 - 2000

Experiencia Profesional

  •   Researcher Full Time

    Universidad de La Habana/Instituto de Materiales y Reactivos

    La Habana, Cuba

    2000 - 2003

  •   Visiting researcher Full Time

    Universidad de Santiago de Chile

    Santiago, Chile

    2003 - 2003

  •   Visiting Researcher Full Time

    Universidad Autónoma de Madrid

    Madrid, España

    2011 - 2012

Formación de Capital Humano


Thesis directed
1. Ernesto Palmero Soler. Diploma thesis. Computational study of the band structure of the compounds Cd3TeO6 and CdTeO3. University of Havana, 2002.
2. Mirla Leal Villoro. Diploma thesis. Excitons in CuCl quantum dots. University of Havana, 2002.
3. Nana Cabo Bisset. Diploma thesis. Study of the exciton-phonon complexes in spherical CdSe quantum dots, University of Havana, 2003.
4. Nana Cabo Bizet. Master thesis. Vibron states in a spherical CdSe quantum dot, University of Havana, 2006. Co-tutor con A. Cabo Montes de Oca y C Trallero-Giner.
5. Jorge Mansilla Sierra. Interacción de los aminoácidos pertenecientes a la secuencia RGD con superficies de dióxido de titanio. Engineer in Bioinformatics, University of Talca, 2010.
6. Javier Camarillo Cisneros, Estudio de la ferroelectricidad en compuestos de elementos de transición. Uso de pseudopotenciales bajo la Teoría del Funcional de la Densidad, Master in Materials Science, Centro de Investigación en Materiales Avanzados, Chihuahua, México, 2010. Co-tutor con Maria E. Fuentes Montero y Luis Fuentes Cobas.6.
7. Marcos Casanova Páez, Study of isolated point charge defects in CdTe by ab-initio calculations. M.Sc. thesis, University of Chile, 2017. Co-tutor con Pablo Palacios
http://repositorio.uchile.cl/handle/2250/145765
8. Karla Kiménez Meza, Estudio teórico de Cu2O y CH3NH3PbI3: estructura electrónica y alineamiento de bandas, examen público el 23 de enero de 2019.
http://repositorio.uchile.cl/handle/2250/159769
9. Felipe Barría Cáceres, Modelación de la interacción de derivados de fullereno con superficie de perovskita híbrida, Seminario de Unidad de Investigación para optar al grado de licenciado en ciencias con mención en Química de la Universidad de Chile, defendida el 30.01.2019. Co-tutor with Ana Montero-Alejo.
10. Juan Alberto Ríos González, Ph.D. thesis (doctorado en fisicoquímica), Estudio teórico-experimental de la formación de una banda intermedia en películas de CdTe dopadas con Bi o Sn aplicadas a celdas solares, Centro de Investigación y de Estudios Avanzados del Instituto Politécnico Nacional, Unidad Mérida, dissertation at 16.12.2019. Co-director with J. L. Peña Chapa.


Difusión y Transferencia


Meeting organization
1) Organization (Director) of Latinamerican School on Computational Materials Science, January 19-30, 2009. Santiago, Chile. http://indico.ictp.it/event/a08192/
2) Tutorial course of the simulation package Quantum-ESPRESSO, Universidad Autónoma de Chihuahua, México, 16-20 February, 2009.
3) Joint ICTP-TWAS Caribbean School on Electronic Structure Fundamentals and Methodologies, 27 August-21 September 2012, Cartagena, Colombia. Tutorial coordinator. Tutorial coordinator. Hand on sessions on: (1) Ab initio Molecular Dynamics, (2) van der Waals Functionals, (3) Metadynamics. http://caribeictp.uis.edu.co/speakers.html
4) Organizing Comitee of VII Workshop on Novel Methods for Electronic Structure Calculations, November 29-December 1, 2017. Santiago, Chile.
5) Workshop Dinámica Molecular en Zeolitas, 8-12 enero 2018, Santiago, Chile. Tutorial course.


Premios y Distinciones

  •   Best Scientific Paper of the University of Havana

    UNIVERSIDAD DE LA HABANA

    Cuba, 1998

    Best Scientific Paper of the University of Havana, for the paper “Optical Vibrons in CdSe Dots and Dispersion Relation of the Bulk Material”, Phys. Rev. B 57, 4664, 1998.

  •   Annual award

    Academia de Ciencias de Cuba

    Chile, 2002

    Award of the Cuban Academy of Sciences for the result “Raman and hyper-Raman scattering in semiconductor quantum dots”, 2002

  •   Junior Associate Member

    INTERNATIONAL CENTRE FOR THEORETICAL PHYSICS (ICTP-TRIESTE)

    Italia, 2002

    Membership in the period 2002-2009. Entitles to spent research visits to the ICTP.


 

Article (65)

Bismuth Doping of CdTe: The Effect of Spin-Orbit Coupling
Chemical Diversity in Lead-Free, Layered Double Perovskites: A Combined Experimental and Computational Approach
Chemical Diversity in Lead-Free, Layered Double Perovskites: A Combined Experimental and Computational Approach (manual)
Inducing a level inside of CdTe bandgap doping with Sn using a co-sublimation technique by CSS
Energetics and Electronic Properties of Interstitial Chlorine in CdTe
Self-compensation in chlorine-doped CdTe
Symmetry and thermodynamics of tellurium vacancies in cadmium telluride
Accuracy of the Heyd-Scuseria-Ernzerhof hybrid functional to describe many-electron interactions and charge localization in semiconductors
Density functional theory study of defects in cadmium telluride: a PBC and QM/MM comparison
Electronic and thermal properties of non-stoichiometric and doped cobaltum antimonide
Influence of chromium hyperdoping on the electronic structure of CH3NH3PbI3 perovskite: a first-principles insight
Optical, Electronic, and Magnetic Engineering of < 111 > Layered Halide Perovskites
Theoretical study of bismuth-doped CdTe
Ferroelectric Domains May Lead to Two-Dimensional Confinement of Holes, but not of Electrons, in CH3NH3PbI3 Perovskite
First principle study of V-implantation in highly-doped silicon materials
Self-compensation in phosphorus-doped CdTe
Sn-doped CdTe as promising intermediate-band photovoltaic material
First-principles DFT plus GW study of oxygen-doped CdTe
First-principles DFT plus GW study of the Te antisite in CdTe
Modeling of Thermal Effect on the Electronic Properties of Photovoltaic Perovskite CH3NH3PbI3: The Case of Tetragonal Phase
Sn doped CdTe as candidate for intermediate-band solar cells: A first principles DFT+GW study
Spin-orbit coupling effects in gold clusters: The case of Au 13
Electronic and atomic structure of complex defects in Al- and Ga-highly doped ZnO films
Evolution of the doping regimes in the Al-doped SnO2 nanoparticles prepared by a polymer precursor method
Nonhydrogenic exciton spectrum in perovskite CH3 NH3 PbI3
Tellurium vacancy in cadmium telluride revisited: Size effects in the electronic properties
Elastic constants and Debye temperature of wz-AlN and wz-GaN semiconductors under high pressure from first-principles
Electronic structure of CdTe using GGA plus USIC
Self-consistent relativistic band structure of the CH3NH3PbI3 perovskite
The absorption spectrum of C-60 in n-hexane solution revisited: Fitted experiment and TDDFT/PCM calculations
Electronic excitations of C-60 aggregates
Paramagnetic shift in thermally annealed CdxZn1-xSe quantum dots
Ultrathin Carbon Nanotube With Single, Double, and Triple Bonds
Computer simulation of elastic constants of hydroxyapatite and fluorapatite
Nitrogen/gold codoping of the TiO2(101) anatase surface. A theoretical study based on DFT calculations
Approximate quantum mechanical method for describing excitations and related properties of finite single-walled carbon nanotubes
Atomistic study of vibrational properties of gamma-Al2O3
Characterization of spin-state tuning in thermally annealed semiconductor quantum dots
Computer simulation study of amorphous compounds: structural and vibrational properties
Core-level shift analysis of amorphous CdTeO (x) materials
Quantitative local environment characterization in amorphous oxides
Ab initio molecular dynamics study of amorphous CdTeOx alloys: Structural properties
Strength of polycrystalline coarse-grained platinum to 330 GPa and of nanocrystalline platinum to 70 GPa from high-pressure x-ray diffraction data
Ab initio calculations of elastic properties of compressed Pt
Ab initio study of Ti3Si0.5Ge0.5C2 under pressure
Elastic properties of the bcc structure of bismuth at high pressure
Exciton-phonon complexes and optical properties in CdSe nanocrystals
Nonhydrostatic compression of bismuth to 222 GPa: Some constraints on elasticity of the bcc-phase
Proposal for a modified Moller-Plesset perturbation theory
Electronic properties of bulk gamma-Al2O3
Comment on The effects of electric field on the electronic structure of a semiconductor quantum dot" [J. Appl. Phys. 84, 1454 (1998)]"
Electric-field and exciton structure in CdSe nanocrystals
Electronic structure of crystalline binary and ternary Cd-Te-O compounds
Resonance Raman scattering in semiconductor quantum dots: Adiabatic versus time-dependent perturbation theory
Resonant Raman scattering off neutral quantum dots
Composition mixture probabilistic model in the formation of semiconductor materials obtained by random growth techniques
Interband absorption and luminescence in small quantum dots under strong magnetic fields
Multiphonon resonant Raman scattering in nanocrystals
Experimental evidence of compositional mixture in CdTeO films grown by radio-frequency sputtering
Resonant hyper-Raman scattering in spherical quantum dots
Resonant Raman scattering in asymmetric semiconductor quantum disks
Resonant Raman scattering in self-assembled quantum dots
Exciton and confinement potential effects on the resonant Raman scattering in quantum dots
Optical vibrons in CdSe dots and dispersion relation of the bulk material
Vibrational resonant Raman scattering in spherical quantum dots: Exciton effects

BookSection (2)

Impact of V-implantation and Si-Vacancies on Crystal Structure and Optical Absorption Properties of Silicon
Electronic structure of photovoltaic perovskites: the case of CH3NH3PbI3

ConferencePaper (2)

Theoretical study of intrinsic defects in CdTe
Electron transition energies of single-walled carbon nanotubes: Hartree - Fock's CNDOL approaches for describing excitations and related properties

Errata (1)

Nonhydrogenic Exciton Spectrum in Perovskite CH3NH3PbI3 (vol 9, pg 559, 2015)

Proyecto (10)

Harnessing stacking order in layered van der Waal structures
Study and improvement of high efficiency photovoltaic materials with atomic-scale quantum calculations
Propiedades de perovskitas híbridas para celdas solares: simulación computacional a escala atómica
Synthesis, characterization and theoretical study of perovskite solar cells based on electrochemically synthesized ZnO nanorods as electron transporting and Cu2O as hole transporting materials
Study of impurities, complex defects, and grain boundaries in CdTe thin films using computer simulation at the atomic scale
Excited states of aperiodic nanotubes and functionalized quantum dots
Electronic states of graphene, carbon nanotubes, fullerenes, and nanocrystals with possible dopants
Simulation of catalysts, reactivity of surfaces of TiO2 and SnO2 doped with C, N, and Sb, interface metal/support, and electronic properties of dye/support systems
Computer simulacion Lab on nano and biosystems
Physics of Novel Solar Cell Materials
91
Eduardo Menendez

Associate Professor

Physics Department

DPTO DE FISICA, FACULTAD DE CIENCIAS, UNIVERSIDAD DE CHILE

Santiago, Chile

11
Mauricio Flores

Investigador

de Física

Grupo de Nanomateriales, Universidad de Chile

Santiago, Chile

8
Ana Montero

Associate professor

Department of Physics

Universidad Tecnológica Metropolitana

Santiago, Chile

8
Gonzalo Gutierrez

Associate Professor

Fisica

FACULTAD DE CIENCIAS, UNIVERSIDAD DE CHILE

Santiago, Chile

2
Sergio Davis

Investigador

Departamento de Ciencias Nucleares

COMISION CHILENA DE ENERGIA NUCLEAR

Santiago, Chile

1
José Rogan

PROFESOR TITULAR

FISICA

FACULTAD DE CIENCIAS, UNIVERSIDAD DE CHILE

Santiago, Chile

1
Walter Orellana

Associate Professor

Physical Science

UNIVERSIDAD ANDRES BELLO

Santiago, Chile

1
Griselda Garcia

Profesor asociado

Física

PONTIFICIA UNIVERSIDAD CATOLICA DE CHILE - FACULTAD DE FÍSICA

Santiago, Chile