Theoretical Chemistry

Charles Coulson's only formal association with the PCL began in the summer of 1945, when he came from Dundee to take up an I.C.I. Fellowship. He left for a Chair of Theoretical Physics at King's College, London in October 1947, but even in this short time he had a remarkable impact, including among his D.Phil. students Christopher Longuet-Higgins, Bill Moffitt and Roy McWeeny, and John Maddox, who was a Part II student. In the spring of 1952, Charles returned to Oxford as Rouse Ball Professor of Mathematics, and established a large and active group which drew visitors from all over the world, and he set up a Summer School in 1955 which he led until 1973 and which, now in the Department of Theoretical Chemistry, runs still. His 5 o'clock seminars on Tuesdays, held in the PCL, were memorable, both for quality and range, but also in the way that Charles moved to the heart of the matter in lucid questions and comment, and if, as sometimes happened, the talk was a difficult one, it could be that it was these clear and precise, but always generously expressed, comments which remained in the mind.

Charles Coulson

Charles Coulson

In 1966 Mark Child joined the laboratory as the first University Lecturer in Theoretical Chemistry with a special teaching responsibility for the newly instituted first year mathematics course. His research interests in molecular collision theory had been stimulated by a year with Herschbach's burgeoning molecular beam group and by the insights these experiments provided into the connections between classical and quantum mechanics. The use of semiclassical techniques has remained an abiding interest, culminating in a graduate text Semiclassical mechanics with molecular applications (OUP, 1991).

Child left the laboratory in 1973 to join the newly established theoretical chemistry department, but he has retained close contacts with those interested in spectroscopy and reaction dynamics. His current research interests lie in the connections between these fields as probes of the fundamental dynamics of isolated molecular systems, in particular in the theories of predissociation, inelastic scattering and intermolecular dynamics.

The Department of Theoretical Chemistry was finally established in 1972. Douglas Abraham had been appointed in 1971, so that the initial establishment of the Department consisted of just three persons, but its research activities were greatly strengthened by the presence of Ian Grant, who held a C.U.F. lectureship in Mathematics. The Department had been set up with the aid of a generous grant from IBM, and, following the untimely death of Charles Coulson in January 1974, funds became available to support three Visiting Professorships, held in 1975 by Rudi Marcus (Illinois), in 1976 by Roy Gordon (Harvard) and in 1978 by Ben Widom (Cornell). Gordon and Marcus were associated with University College: Widom began the equally happy association of our distinguished visitors with St Catherine's College. Norman March was appointed the Coulson Professor of Theoretical Chemistry in 1977. He retires in 1994 when it is proposed that Theoretical Chemistry and the PCL be united to form a Department of Physical and Theoretical Chemistry, and containing the Dr Lee's and the Coulson chairs.

Departmental Computers Computer-aided Molecular Design