La Teoría del Funcional Densidad se ha convertido en una de las herramientas de trabajo más utilizadas actualmente dentro de la Química Teórica y Computacional, independientemente del campo de aplicación de ésta, gracias a su capacidad predictiva a un coste computacional razonablemente moderado. Entre dichos campos de aplicación, se encuentran sin duda la ciencia de materiales, la química y física del estado sólido, la nanotecnología, la química orgánica y farmaceútica, etc.
Course content (verified by ANECA in official undergraduate and Master’s degrees)
Specific Competences:>>specialisation
CEE24 :
Understand the levels of theoretical calculation for studying properties of chemical and physical interest.
CEE27 :
Understand the theoretical foundations and applications of the Density Functional Theory.
CEE29 :
Understand numerical calculus techniques as applied to materials science.
Learning outcomes (Training objectives)
No data
Specific objectives stated by the academic staff for academic year 2021-22
No data
General
Code:35834 Lecturer responsible: SANCHO GARCIA, JUAN CARLOS Credits ECTS:3,00
Theoretical credits:
0,80
Practical credits:
0,40
Distance-base hours:
1,80
Departments involved
Dept:
PHYSICAL CHEMISTRY Area:
PHYSICAL CHEMISTRY Theoretical credits: 0,8 Practical credits: 0,4
This Dept. is responsible for the course.
This Dept. is responsible for the final mark record.
