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Oscar Olvera Neria
Dr Óscar Olvera Neria
Full professor. Óscar is in charge of the main features of the computational lab, managing both the hardware and software, compiling and tunning all the programs that runs on our computer servers.
Research interests
- Photocatalyst with Metal Oxides.
- Transition Metal Catalyst.
- Genetic Algorithms for Molecular Structures.
- Reaction Mechanism using DFT.
Contact
Email: oon@azc.uam.mx
ResearchGate
Tel.
(+52) 55 53 1895 05
Dr Enrique Poulain
Full professor. He studied his PhD at the Uppsala University. Here in México Enrique has collaborated with Ricardo Gómez, Osvaldo Goscinski, Jésus Morales among others.
Research interests
- Transition Metal Catalyst.
- Multiconfigurational SCF calculations.
- Spin contamination.
Contact
Email: enro@azc.uam.mx
Julio Cesar Gonzalez Torres
Dr Julio González Torres
Adjunct Professor. He studied his PhD at Universidad Autónoma Metropolitana. He was awarded with the medal disctintion, both for his Master and PhD, for the best grades. He was also recognized with the best thesis award for best research work in the field of science.
Research interests
- Dye degradation (DFT).
- MOFS electronic density.
- TiO2, Fe2O3, ZIF's.
- VASP, ORCA, BASH, Python, html.
Contact
Email: jcgt@azc.uam.mx
ResearchGate ORCID Scholar
Raul Garcia Cruz
M.S. Raúl García Cruz
Adjunct Professor. He studied his Master at Universidad Autónoma Metropolitana. He was awarded with the medal disctintion for the best grades in the Master program of Material Science and Engineering.
Research interests
- Bimetal nanoclusters (DFT)
- Transition State Theory.
- Intrinsic Reaction Coordinate.
Contact
Email: rgc@azc.uam.mx
ResearchGate ORCID
Tel. (+52) 55 53 1895 05
Victor Daniel Dominguez Soria
Dr. Víctor Domínguez
Associate Professor. He studied his PhD at the CINVESTAV. He is a member of the Química Aplicada research group at the UAM-Azcapotzalco.
Research interests
- Density Maps Visualization.
- Density Functional Theory.
- Molecular Organic Frameworks.
Contact
Email: vdds@azc.uam.mx.
Luis Antonio Cipriano Marcos
M.S. Antonio Cipriano Marcos
PhD Student. He studied his Master at Universidad Autónoma Metropolitana. Currently he is studying its PhD at the Università degli Studi di Milano-Bicocca, under the guidance of Professor Gianfranco Pacchioni.
Research interests
- Solid State Physics.
- Heterojunctions of Metal Oxides.
- VASP, ORCA, python.
Contact
Email: lantonio_cm@proton...
ResearchGate ORCID

M.S. Arnulfo Montoya Moreno

PhD Student
Research
- Genetic Algorithms.
- Fe2O3 Metal oxides.

Contact
arnulfomontoya@gmail.com

Eng. Lucia Alvarez Valencia

Chemical Engineer
Research
- VASP, ORCA.
- Metal Organic Framework.
- Zeolites Clinoptilolite.

Contact
lucia_av@protonmail.com

Gabriela García Mendoza

Undergraduate Student
Research
- Hydroxyl radical degradation.
- Degradation of pharmaceutical compounds.
- DFT software ORCA 5.0.3
Contact
gsgm@azc.uam.mx

Egresados
M.S. Fernanda Tonantzin Martínez, Master on Materials Science and Engineer UAM-A. Tesis: Rol de los planos cristalogr´ficos {0001} y {01-12} de la alfa-Fe2O3 en la remoción del arsénico.
M.S. Miriam Ballesteros Olvera, Master on Materials Science and Engineer UAM-A. Tesis: Fonones ab initio para el cálculo de la conductividad térmica en TiO2
En. Alfonso Nájera Gil, B.A Physical Engineer UAM-A. Tesis: Estudio geométrico y electrónico mediante algoritmos genéticos y DFT .
En. Madelin Rodríguez Ángeles, B.A Chemical Engineer UAM-A. Tesis: Efecto del equilibrio tautomérico en la degradación del AA7.
En. Indira Suárez López, B.A Physical Engineer UAM-A. Tesis: Adsorción de cúmulos de Au sobre alpha-Fe2O3 hematita.