Fundamentals of computational chemistry
Subject classification: this is a chemistry resource. |
This page deals with developing materials related to Computational chemistry
There is a text book being written at b:Computational chemistry and another book on b:Mathematics for chemistry. Both these books contain student exercises.
Research Project in Computational Chemistry
editThere is a project with two objectives, 1) to produce some educational molecular level models of wood, lignite and coal, and 2) to produce a review article about molecular level modelling of coal and clean coal processes. The beginnings of the review exist on the the Academic Publishing Wiki [wiki] in Interpretations in the Physical and Computational Sciences [[1]].
Contributions are solicited, particularly over which open source modelling code should be used.
For discussion see Talk:Fundamentals of computational chemistry.
Learning Computational Chemistry by doing
editA whole new project on learning computational chemistry is planned to develop from these links to five modules: