Chemical Modelling
Stockholm University
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Studietakt: 100 %
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Chemical Modelling
Utbildningsinformation från den publicerade källan. Utbildningen och dess tidsbundna tillfällen hålls åtskilda.
Utbildningsfakta
Kod: KZ7002
The course is expected to give a good orientation and useful skills in modern computer modelling/simulation of chemical systems as bulk, aggregate and at surfaces. It will start by introductory quantum mechanics, statistical thermodynamics and kinetics. Several important state-of-the-art techniques in the computational chemistry and materials science will be introduced including quantum chemical (density functional theory), molecular dynamics and Monte Carlo calculations. We will then take physical models to compute structures and properties of matter across length scales from atoms to (almost) macroscale by combining several computational techniques based on a multiscale concept. Practical training to chemical modelling will be given in computer laborations using both commercial and in-house software, for studies of for example biological membranes and porous materials.
Behörighet
Requires 60 hp (ECTS) in chemistry, of which at least 15 hp (ECTS) should be in physical chemistry, and an additional 15 hp (ECTS) in mathematics. Also required is knowledge equivalent to Swedish upper secondary course English B or equivalent.
Utbildningstillfällen
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Publiceringsversion: 8e217193-f5fa-4778-b085-a4521fd03e8d
Kontrollsumma: 1b0dc54c0fc8a359f83ba9dc8f9d468479ce432de4c03bce3b8b33dd67fe3f6c
Senast ändrad enligt källan: 2026-02-09T15:10:30