Zobrazeno 1 - 10
of 15
pro vyhledávání: '"Anjay Manian"'
Autor:
Anjay Manian, Salvy P. Russo
Publikováno v:
Scientific Reports, Vol 12, Iss 1, Pp 1-12 (2022)
Abstract The first order and second order corrected photoluminescence quantum yields are computed and compared to experiment for naphthalene in this manuscript discussing negative results. Results for anthracene and tetracene are recalled from previo
Externí odkaz:
https://doaj.org/article/83bceaa57d6d4d868bb3cb28c733aca9
Publikováno v:
Journal of Chemical Theory and Computation. 19:271-292
We present the first benchmarking study of nonadiabatic matrix coupling elements (NACMEs) calculated using different density functionals. Using the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4b9acc995cac46d91e5b8de7037a53f2
https://doi.org/10.1021/acs.jctc.2c00888
https://doi.org/10.1021/acs.jctc.2c00888
Publikováno v:
The Journal of Chemical Physics. 158
The absorption spectra of congenetic wurtzite (WZ) and zincblende (ZB) CdS magic-sized clusters are investigated. We demonstrate that the exciton peak positions can be tuned by up to 500 meV by varying the strong coupling between X-type ligands and t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::db05bf2f7c116b74d78f8a25e2b47bde
https://doi.org/10.1063/5.0147609
https://doi.org/10.1063/5.0147609
Autor:
Renzo A. Fenati, Zifei Chen, Yasuko Yamagishi, Kaori Tsukakoshi, Kazunori Ikebukuor, Anjay Manian, Salvy P. Russo, Tomohiko Yamazaki, Amanda V. Ellis
Publikováno v:
Journal of Materials Chemistry B. 10:8960-8969
Enhancement of DNZymatic activity using a combined iterativein silicoandin vitromethod as a cheaper and more stable alternative to antibodies or enzymes.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::cc7c9366974342242df5f2a722186467
https://doi.org/10.1039/d2tb01638a
https://doi.org/10.1039/d2tb01638a
Publikováno v:
RSC Advances. 12:25440-25448
Phosphorescence is naturally spin-forbidden, and weak. Consequentially, to build the operator, one needs help from other excited states. Unfortunately, sometimes some states are more difficult to deal with than others.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::81b9e23ae76e282d2656c3ce9e7d672e
https://doi.org/10.1039/d2ra03447f
https://doi.org/10.1039/d2ra03447f
Publikováno v:
The Journal of Physical Chemistry C. 125:23646-23656
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::74be23547d0c34ccc5d57ead0ca25bf7
https://doi.org/10.1021/acs.jpcc.1c07929
https://doi.org/10.1021/acs.jpcc.1c07929
Autor:
Rehana Pervin, Anjay Manian, Zifei Chen, Andrew J. Christofferson, Tze Cin Owyong, Siobhan J. Bradley, Jonathan M. White, Kenneth P. Ghiggino, Salvy P. Russo, Wallace W.H. Wong
Publikováno v:
Journal of Photochemistry and Photobiology A: Chemistry. 436:114364
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::780c8504968866fa930216adab8a98bf
https://doi.org/10.1016/j.jphotochem.2022.114364
https://doi.org/10.1016/j.jphotochem.2022.114364
Autor:
Wallace W. H. Wong, Jonathan M. White, Igor Lyskov, Girish Lakhwani, Randy P. Sabatini, David J. Jones, Bolong Zhang, Hamid Soleimaninejad, Trevor A. Smith, Anjay Manian, Lachlan J. Wilson, Salvy P. Russo, Kenneth P. Ghiggino
Publikováno v:
Journal of Materials Chemistry C. 8:8953-8961
The photoluminescence quantum yield (ϕPL) of perylene diimide derivatives (PDIs) is often limited by aggregation caused quenching (ACQ) at high concentration or in the neat solid-state. Energy transfer in high dye concentration systems is also a key
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::be7bebefabd56f132062fbfc35102fe1
https://doi.org/10.1039/d0tc02108c
https://doi.org/10.1039/d0tc02108c
Publikováno v:
Journal of chemical theory and computation. 18(3)
Ab initio treatments of interexcited state internal conversion (IC) are more often than not missing from exciton dynamic descriptions, because of their inherent complexity. Here, we define "interexcited state IC" as a same-spin nonradiative transitio
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::70aeadc76d4e00350f3706da3ff9077f
https://pubmed.ncbi.nlm.nih.gov/35196857
https://pubmed.ncbi.nlm.nih.gov/35196857
Publikováno v:
Physical chemistry chemical physics : PCCP. 24(5)
In this paper, we investigate the efficacy of different quantum chemical solvent modelling methods of indole in both water and methylcyclohexane solutions. The goal is to show that one can yield good photophysical properties in strongly coupled solut
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2dea77948c586177cb0f7829d3b717c9
https://pubmed.ncbi.nlm.nih.gov/35060986
https://pubmed.ncbi.nlm.nih.gov/35060986