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TDDFT Study of the Electronic Structure, Absorption and Emission Spectra of the Light Emitters of the Amazing Firefly Bioluminescence and Solvation Effects on the Spectra.
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- Chinese Journal of Chemistry, 2008, v. 26, n. 1, p. 55, doi. 10.1002/cjoc.200890038
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- Article
Understanding the effects of the number of pyrazines and their positions on charge-transport properties in silylethynylated N-heteropentacenes.
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- Journal of Molecular Modeling, 2014, v. 20, n. 11, p. 1, doi. 10.1007/s00894-014-2502-3
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- Article
Computational study of the electronic structures, UV-Vis spectra and static second-order nonlinear optical susceptibilities of macrocyclic thiophene derivatives.
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- Journal of Molecular Modeling, 2012, v. 18, n. 1, p. 393, doi. 10.1007/s00894-011-1082-8
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- Article
Theoretical Investigation on the Origin of Yellow-Green Firefly Bioluminescence by Time-Dependent Density Functional Theory.
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- ChemPhysChem, 2010, v. 11, n. 10, p. 2199, doi. 10.1002/cphc.200900821
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- Article
A Time-Dependent Density Functional Theory Investigation on the Origin of Red Chemiluminescence.
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- ChemPhysChem, 2010, v. 11, n. 1, p. 251, doi. 10.1002/cphc.200900607
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- Article
Theoretical investigation of one- and two-photon spectra of pyrazabole chromophores.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 130, n. 1, p. 37, doi. 10.1007/s00214-011-0956-2
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- Article
A theoretical study on magnesium ion-selective two-photon fluorescent probe based on benzo [h] chromene derivatives.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 130, n. 1, p. 61, doi. 10.1007/s00214-011-0960-6
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- Article
Theoretical study of one- and two-photon absorption properties of pyrene derivatives.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 128, n. 2, p. 265, doi. 10.1007/s00214-010-0842-3
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- Article
A Theoretical Investigation of Two Typical Two-Photon pH Fluorescent Probes.
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- Photochemistry & Photobiology, 2013, v. 89, n. 2, p. 300, doi. 10.1111/php.12015
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- Article
Theoretical investigation of two-photon absorption and fluorescence properties of cypridina luciferin-based derivatives: 2,3,5-trisubstituted pyrazine compounds.
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- Journal of Physical Organic Chemistry, 2013, v. 26, n. 10, p. 822, doi. 10.1002/poc.3177
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- Article
A Theoretical Investigation into the Homo- and Hetero-leptic Cu(I) Phosphorescent Complexes Bearing 2,9-dimethyl-1,10-phenanthroline and bis [2-(diphenylphosphino)phenyl]ether Ligand.
- Published in:
- Materials (1996-1944), 2022, v. 15, n. 20, p. 7253, doi. 10.3390/ma15207253
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- Article