Ab initio calculations of three-photon absorption
2003 (English)In: Chemical Physics Letters, ISSN 0009-2614, E-ISSN 1873-4448, Vol. 375, no 02-jan, 233-239 p.Article in journal (Refereed) Published
We present large scale ab initio calculations of three-photon absorption of a series of dithienothiophene based charge transfer molecules using response theory within the random phase approximation. The structure-to-property relations obtained for the three-photon absorption cross-sections are discussed and compared with those for one- and two-photon absorption.
Place, publisher, year, edition, pages
2003. Vol. 375, no 02-jan, 233-239 p.
multiphoton ionization spectroscopy, 2-photon absorption, response functions, cross-sections, state, benzene, phase, chromophores, excitation, transition
IdentifiersURN: urn:nbn:se:kth:diva-22639DOI: 10.1016/s0009-2614(03)00826-1ISI: 000183931400036OAI: oai:DiVA.org:kth-22639DiVA: diva2:341337
QC 201005252010-08-102010-08-10Bibliographically approved