Quantum chemical modeling of components of dye-sensitized solar cells
Publication type: Journal Article
Publication date: 2013-03-01
scimago Q4
wos Q4
SJR: 0.153
CiteScore: 1.1
Impact factor: 0.5
ISSN: 00271314, 19350260
General Chemistry
Abstract
Ab initio approaches of quantum chemistry, including the fragment molecular orbital (FMO) method, as well as the multiconfigurational quasidegenerate perturbation theory (XMCQDPT2) and time-dependent density functional theory (TD DFT) were applied to compute optical spectra of a polyene dye molecule on the surface of titanium dioxide.
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Polyakov I. V. et al. Quantum chemical modeling of components of dye-sensitized solar cells // Moscow University Chemistry Bulletin. 2013. Vol. 68. No. 2. pp. 77-79.
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Polyakov I. V., Moskovskii A. A., Khrenova M. G., Nemukhin A. V. Quantum chemical modeling of components of dye-sensitized solar cells // Moscow University Chemistry Bulletin. 2013. Vol. 68. No. 2. pp. 77-79.
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TY - JOUR
DO - 10.3103/S0027131413020089
UR - http://link.springer.com/10.3103/S0027131413020089
TI - Quantum chemical modeling of components of dye-sensitized solar cells
T2 - Moscow University Chemistry Bulletin
AU - Polyakov, I. V.
AU - Moskovskii, A A
AU - Khrenova, M. G.
AU - Nemukhin, A. V.
PY - 2013
DA - 2013/03/01
PB - Allerton Press
SP - 77-79
IS - 2
VL - 68
SN - 0027-1314
SN - 1935-0260
ER -
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BibTex (up to 50 authors)
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@article{2013_Polyakov,
author = {I. V. Polyakov and A A Moskovskii and M. G. Khrenova and A. V. Nemukhin},
title = {Quantum chemical modeling of components of dye-sensitized solar cells},
journal = {Moscow University Chemistry Bulletin},
year = {2013},
volume = {68},
publisher = {Allerton Press},
month = {mar},
url = {http://link.springer.com/10.3103/S0027131413020089},
number = {2},
pages = {77--79},
doi = {10.3103/S0027131413020089}
}
Cite this
MLA
Copy
Polyakov, I. V., et al. “Quantum chemical modeling of components of dye-sensitized solar cells.” Moscow University Chemistry Bulletin, vol. 68, no. 2, Mar. 2013, pp. 77-79. http://link.springer.com/10.3103/S0027131413020089.