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Aguilar, Charles M., De Almeida, Wagner B., Rocha, Willian R. (2008) Solvation and electronic spectrum of Ni2+ ion in aqueous and ammonia solutions: A sequential Monte Carlo/TD-DFT study. Chemical Physics, 353. 66-72 doi:10.1016/j.chemphys.2008.07.014

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Reference TypeJournal (article/letter/editorial)
TitleSolvation and electronic spectrum of Ni2+ ion in aqueous and ammonia solutions: A sequential Monte Carlo/TD-DFT study
JournalChemical Physics
AuthorsAguilar, Charles M.Author
De Almeida, Wagner B.Author
Rocha, Willian R.Author
Year2008 (November)Volume353
PublisherElsevier BV
DOIdoi:10.1016/j.chemphys.2008.07.014Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID5961783Long-form Identifiermindat:1:5:5961783:9
GUID0
Full ReferenceAguilar, Charles M., De Almeida, Wagner B., Rocha, Willian R. (2008) Solvation and electronic spectrum of Ni2+ ion in aqueous and ammonia solutions: A sequential Monte Carlo/TD-DFT study. Chemical Physics, 353. 66-72 doi:10.1016/j.chemphys.2008.07.014
Plain TextAguilar, Charles M., De Almeida, Wagner B., Rocha, Willian R. (2008) Solvation and electronic spectrum of Ni2+ ion in aqueous and ammonia solutions: A sequential Monte Carlo/TD-DFT study. Chemical Physics, 353. 66-72 doi:10.1016/j.chemphys.2008.07.014
In(n.d.) Chemical Physics Vol. 353. Elsevier BV

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Aguilar, Charles M., De Almeida, Wagner B., Rocha, Willian R. (2007) The electronic spectrum of Fe2+ ion in aqueous solution: A sequential Monte Carlo/quantum mechanical study. Chemical Physics Letters, 449. 144-148 doi:10.1016/j.cplett.2007.10.063
Rocha, Willian R, De Almeida, Katia J, Coutinho, K, Canuto, Sylvio (2001) The electronic spectrum of N-methylacetamide in aqueous solution: a sequential Monte Carlo/quantum mechanical study. Chemical Physics Letters, 345. 171-178 doi:10.1016/s0009-2614(01)00834-x
Rocha, Willian R., De Almeida, Kátia J., De Almeida, Wagner B. (2000) Liquid tin tetrachloride: a Monte Carlo simulation study. Chemical Physics Letters, 316. 510-516 doi:10.1016/s0009-2614(99)01311-1
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Junqueira, Georgia M.A., Rocha, Willian R., De Almeida, Wagner B., Dos Santos, Hélio F. (2005) Theoretical analysis of the oxocarbons: the electronic spectrum of the rhodizonate ion. Journal of Molecular Structure: THEOCHEM, 719. 31-39 doi:10.1016/j.theochem.2005.01.021
de Almeida, Kátia J., Coutinho, Kaline, de Almeida, Wagner B., Rocha, William R., Canuto, Sylvio (2001) A Monte Carlo–quantum mechanical study of the solvatochromism of pyrimidine in water and in carbon tetrachloride. Physical Chemistry Chemical Physics, 3 (9). 1583-1587 doi:10.1039/b100374g
Da Silva, Júlio C.S., De Almeida, Wagner B., Rocha, Willian R. (2009) Theoretical investigation of the structure and nature of the interaction in metal–alkane σ-complexes of the type [M(CO)5(C2H6)] (M=Cr, Mo, and W). Chemical Physics, 365. 85-93 doi:10.1016/j.chemphys.2009.10.008
Junqueira, Georgia M.A., Rocha, Willian R., De Almeida, Wagner B., Dos Santos, Hélio F. (2004) Theoretical study of oxocarbons: structure and vibrational spectrum of the D6h and C2 forms of the rhodizonate ion. Journal of Molecular Structure: THEOCHEM, 684. 141-147 doi:10.1016/j.theochem.2004.07.020
Rocha, Willian R., De Almeida, Wagner B. (1997) Quantum-mechanical vibrational spectrum and conformational analysis for the 1,5-cyclooctadiene. Vibrational Spectroscopy, 13 (2) 213-219 doi:10.1016/s0924-2031(96)00045-8
 
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