Study programme 2023-2024Français
Applied simulation methods to Chemistry
Programme component of Bachelor's in Chemistry (MONS) (day schedule) à la Faculty of Science

CodeTypeHead of UE Department’s
contact details
Teacher(s)
US-B2-SCCHIM-015-MCompulsory UEQUARTI ClaudioS817 - Chimie des matériaux nouveaux
  • QUARTI Claudio

Language
of instruction
Language
of assessment
HT(*) HTPE(*) HTPS(*) HR(*) HD(*) CreditsWeighting Term
  • Français
Français10000022.002nd term

AA CodeTeaching Activity (AA) HT(*) HTPE(*) HTPS(*) HR(*) HD(*) Term Weighting
S-CHIM-600Applied simulation methods to Chemistry100000Q2100.00%

Programme component

Objectives of Programme's Learning Outcomes

  • Grow personally and professionally
    • Have developed, in the context of chemistry, generic skills that are applicable in many other contexts, particularly in the use of the English language, scientific programming, and safety and risk in the laboratory

Learning Outcomes of UE

Acquire basic practical skills for the numerical solution of mathematical problems, especially in the context of modern chemistry

UE Content: description and pedagogical relevance

The course aims to train the students in the use of numerical tools, through the analysis and solution of cases of real interest in chemistry, following a "learn-by-practice" approach. In detail, the course will propose four pillars. Each pillar aims at solving a mathematical problem with direct applications in chemistry:
- statistical treatment of chemical measurements
- treatment of vectors and matrices in the 3d space for the analysis of molecular structures
- diagonalization of hermitian matrices for the numerical solution of the model of molecular orbitals. 
- numerical solution of one-dimensional differential equation for kinetic reaction models.

Prior Experience

General knowledge in the field of information and communication technology

Type of Teaching Activity/Activities

AAType of Teaching Activity/Activities
S-CHIM-600
  • Cours magistraux

Mode of delivery

AAMode of delivery
S-CHIM-600
  • Face-to-face

Required Learning Resources/Tools

AARequired Learning Resources/Tools
S-CHIM-600Not applicable

Recommended Learning Resources/Tools

AARecommended Learning Resources/Tools
S-CHIM-600Not applicable

Other Recommended Reading

AAOther Recommended Reading
S-CHIM-600Not applicable

Grade Deferrals of AAs from one year to the next

AAGrade Deferrals of AAs from one year to the next
S-CHIM-600Authorized

Term 2 Assessment - type

AAType(s) and mode(s) of Q2 assessment
S-CHIM-600
  • Oral examination - Face-to-face

Term 2 Assessment - comments

AATerm 2 Assessment - comments
S-CHIM-600Oral examination with preparation

Term 3 Assessment - type

AAType(s) and mode(s) of Q3 assessment
S-CHIM-600
  • Oral examination - Face-to-face

Term 3 Assessment - comments

AATerm 3 Assessment - comments
S-CHIM-600Oral examination with written preparation
(*) HT : Hours of theory - HTPE : Hours of in-class exercices - HTPS : hours of practical work - HD : HMiscellaneous time - HR : Hours of remedial classes. - Per. (Period), Y=Year, Q1=1st term et Q2=2nd term
Date de dernière mise à jour de la fiche ECTS par l'enseignant : 23/08/2023
Date de dernière génération automatique de la page : 04/05/2024
20, place du Parc, B7000 Mons - Belgique
Tél: +32 (0)65 373111
Courriel: info.mons@umons.ac.be