Change search
CiteExportLink to record
Permanent link

Direct link
Cite
Citation style
  • apa
  • ieee
  • modern-language-association-8th-edition
  • vancouver
  • Other style
More styles
Language
  • de-DE
  • en-GB
  • en-US
  • fi-FI
  • nn-NO
  • nn-NB
  • sv-SE
  • Other locale
More languages
Output format
  • html
  • text
  • asciidoc
  • rtf
Advances in computationalphotochemistry and chemiluminescenceof biological and nanotechnologicalmolecules
KTH, School of Biotechnology (BIO), Theoretical Chemistry and Biology.ORCID iD: 0000-0002-8453-5664
Show others and affiliations
2017 (English)In: Photochemistry / [ed] Elisa Fasani and Angelo Albini, Royal Society of Chemistry, 2017, 44, p. 16-60Chapter in book (Refereed)
Abstract [en]

Recent advances (2014–2015) in computational photochemistry and chemiluminescencederive from the development of theory and from the application of state-of-the-art andnew methodology to challenging electronic-structure problems. Method developmentshave mainly focused, first, on the improvement of approximate and cheap methods toprovide a better description of non-adiabatic processes, second, on the modification ofaccurate methods in order to decrease the computation time and, finally, on dynamicsapproaches able to provide information that can be directly compared with experimentaldata, such as yields and lifetimes. Applications of the ab initio quantum-chemistry methodshave given rise to relevant findings in distinct fields of the excited-state chemistry.We brieflysummarise, in this chapter, the achievements on photochemical mechanisms andchemically-induced excited-state phenomena of interest in biology and nanotechnology.

Place, publisher, year, edition, pages
Royal Society of Chemistry, 2017, 44. p. 16-60
National Category
Theoretical Chemistry
Identifiers
URN: urn:nbn:se:kth:diva-215153OAI: oai:DiVA.org:kth-215153DiVA, id: diva2:1146666
Note

QC 20171004

Available from: 2017-10-03 Created: 2017-10-03 Last updated: 2017-10-04Bibliographically approved

Open Access in DiVA

fulltext(9077 kB)53 downloads
File information
File name FULLTEXT01.pdfFile size 9077 kBChecksum SHA-512
2f179a8dd158849f6f7b0de316ff3eeb79461f6a98b44a5fa63e39980836a6af7a35e0ce654133ca80f022e1abf0f5f6c99976f2027714933f003e10f4b25ae3
Type fulltextMimetype application/pdf

Search in DiVA

By author/editor
Farahani, Pooria
By organisation
Theoretical Chemistry and Biology
Theoretical Chemistry

Search outside of DiVA

GoogleGoogle Scholar
Total: 53 downloads
The number of downloads is the sum of all downloads of full texts. It may include eg previous versions that are now no longer available

urn-nbn

Altmetric score

urn-nbn
Total: 160 hits
CiteExportLink to record
Permanent link

Direct link
Cite
Citation style
  • apa
  • ieee
  • modern-language-association-8th-edition
  • vancouver
  • Other style
More styles
Language
  • de-DE
  • en-GB
  • en-US
  • fi-FI
  • nn-NO
  • nn-NB
  • sv-SE
  • Other locale
More languages
Output format
  • html
  • text
  • asciidoc
  • rtf