Dohn, Asmus Ougaard.

Transient changes in molecular geometrics and how to model them : simulating chemical reactions of metal complexes in solution to explore dynamics, solvation, coherence, and the link to experiment / Asmus Ougaard Dohn. - Switzerland : Springer, 2015. - xxxviii, 146 p. : charts, graphs. - (Springer theses) .

Doctoral thesis accepted by the Technical University of Denmark.

Includes bibliographical references.

9783319187464


Molecular dynamics--Simulation methods.
Molecular structure.
Transition metal complexes.

QD461 / D64