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Results 1 to 25 of 113588

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σ, π aromaticity and anti-aromaticity as retrieved by the linear response kernelFIAS, Stijn; GEERLINGS, Paul; AYERS, Paul et al.PCCP. Physical chemistry chemical physics (Print). 2013, Vol 15, Num 8, pp 2882-2889, issn 1463-9076, 8 p.Article

Enhancement of the Quinoidal Character for Smaller [n]Cycloparaphenylenes Probed by Raman SpectroscopyFUJITSUKA, Mamoru; IWAMOTO, Takahiro; KAYAHARA, Eiichi et al.ChemPhysChem (Print). 2013, Vol 14, Num 8, pp 1570-1572, issn 1439-4235, 3 p.Article

The fundamental chemical equation of aromaticityCHAUVIN, Remi; LEPETIT, Christine.PCCP. Physical chemistry chemical physics (Print). 2013, Vol 15, Num 11, pp 3855-3860, issn 1463-9076, 6 p.Article

Assessment of aromaticity via molecular response propertiesLAZZERETTI, Paolo.PCCP. Physical chemistry chemical physics (Print). 2004, Vol 6, Num 2, pp 217-223, issn 1463-9076, 7 p.Article

A Computational Study on 3-Azonia-, 3-Phosphonia-, and 3-Arsoniaspiro[2.2]pentanes and Related Three-Membered HeterocyclesTRUJILLO, Cristina; SANCHEZ-SANZ, Goar; ALKORTA, Ibon et al.ChemPhysChem (Print). 2014, Vol 15, Num 16, pp 3493-3501, issn 1439-4235, 9 p.Article

The origin of the ring current in the all-metal aromatic, Al42-HAVENITH, Remco W. A; FOWLER, Patrick W.PCCP. Physical chemistry chemical physics (Print). 2006, Vol 8, Num 29, pp 3383-3386, issn 1463-9076, 4 p.Article

Ribbon aromaticity in double-chain planar BnH22― and Li2BnH2 nanoribbon clusters up to n = 22: lithiated boron dihydride analogues of polyenesHUI BAI; QIANG CHEN; MIAO, Chang-Qing et al.PCCP. Physical chemistry chemical physics (Print). 2013, Vol 15, Num 43, pp 18872-18880, issn 1463-9076, 9 p.Article

2,1,3-Benzothiadiazole: Study of its structure, energetics and aromaticityMIRANDA, Margarida S; MATOS, M. Agostinha R; MORAIS, Victor M. F et al.Journal of chemical thermodynamics. 2012, Vol 50, pp 30-36, issn 0021-9614, 7 p.Article

Predicting SARA composition of crude oil by means of NMRSANCHEZ-MINERO, Felipe; ANCHEYTA, Jorge; SILVA-OLIVER, Guadalupe et al.Fuel (Guildford). 2013, Vol 110, pp 318-321, issn 0016-2361, 4 p.Conference Paper

Relation of chemical properties of soil humic acids to decolorization by white rot fungus: Coriolus consorsYANAGI, Yukiko; HAMAGUCHI, Seiji; TAMAKI, Hajime et al.Soil Science and Plant Nutrition (Tokyo). 2003, Vol 49, Num 2, pp 201-206, issn 0038-0768, 6 p.Article

Efficient mapping of ring currents in fullerenes and other curved carbon networksSONCINI, Alessandro; VIGLIONE, Rosario G; ZANASI, Riccardo et al.Comptes rendus. Chimie. 2006, Vol 9, Num 7-8, pp 1085-1093, issn 1631-0748, 9 p.Article

Determination of Hassi Messaoud asphaltene aromatic structure from 1H & 13C NMR analysisFERGOUG, T; BOUHADDA, Y.Fuel (Guildford). 2014, Vol 115, pp 521-526, issn 0016-2361, 6 p.Article

Water-in-Crude Oil Emulsions in the Burgan Oilfield : Effects of Oil Aromaticity, Resins to Asphaltenes Content (R/(R + A)), and Water pHELSHARKAWY, Adel M; YARRANTON, Harvey W; AL-SAHHAF, Tahar A et al.Journal of dispersion science and technology. 2008, Vol 29, Num 2, pp 224-229, issn 0193-2691, 6 p.Article

DFT molecular dynamics study of pyrene biradical speciesGARCIA-CRUZ, I; MARTINEZ-MAGADAN, J.-M.Petroleum science and technology. 2007, Vol 25, Num 1-2, pp 67-80, issn 1091-6466, 14 p.Article

σ-π Energy separation in homodesmotic reactionsHOHINEICHER, Georg; PACKSCHIES, Lars; WEBER, Johannes et al.ChemPhysChem (Print). 2005, Vol 6, Num 12, pp 2541-2551, issn 1439-4235, 11 p.Article

Design of the sandwich-like compounds based on the all-metal aromatic unit Al3YANG, Li-Ming; DING, Yi-Hong; SUN, Chia-Chung et al.ChemPhysChem (Print). 2006, Vol 7, Num 12, pp 2478-2482, issn 1439-4235, 5 p.Article

Aromaticity of heterocycles containing heavy elementsSALCEDO, Roberto.Structural analysis of cyclic systems (2005). 2005, pp 143-156, isbn 81-308-0055-1, 14 p.Book Chapter

The electron density vs. NICS scan: a new approach to assess aromaticity in molecules with different ring sizesFOROUTAN-NEJAD, Cina; SHAHBAZIAN, Shant; RASHIDI-RANJBAR, Parviz et al.PCCP. Physical chemistry chemical physics (Print). 2010, Vol 12, Num 39, pp 12630-12637, issn 1463-9076, 8 p.Article

Wormholes in chemical space connecting torus knot and torus link π-electron density topologiesRZEPA, Henry S.PCCP. Physical chemistry chemical physics (Print). 2009, Vol 11, Num 9, pp 1340-1345, issn 1463-9076, 6 p.Article

Aromaticity and magnetotropicity of dicyclopenta-fused polyacenesMAKINO, Masakazu; AIHARA, Jun-Ichi.PCCP. Physical chemistry chemical physics (Print). 2008, Vol 10, Num 4, pp 591-599, issn 1463-9076, 9 p.Article

Stability of Water-in-Crude Oil Emulsions : Effect of Oil Aromaticity, Resins to Asphaltene Ratio, and pH of WaterAL-SAHHAF, T; ELSHARKAWY, A; FAHIM, M et al.Petroleum science and technology. 2008, Vol 26, Num 16-18, pp 2009-2022, issn 1091-6466, 14 p.Article

Characterization of humic substances isolated from Han River water and change in the structural and chemical characteristics by ozonationYU, M. J; KIM, Y. H; HAN, I et al.Environmental technology. 2005, Vol 26, Num 9, pp 1033-1041, issn 0959-3330, 9 p.Article

Functionalized corannulene cations: a detailed theoretical surveyROGACHEV, Andrey Yu; FILATOV, Alexander S; ZABULA, Alexander V et al.PCCP. Physical chemistry chemical physics (Print). 2012, Vol 14, Num 10, pp 3554-3567, issn 1463-9076, 14 p.Article

Many M©Bn boron wheels are local, but not global minimaYUNLONG LIAO; LETICIA CRUZ, Clara; VON RAGUE SCHLEYER, Paul et al.PCCP. Physical chemistry chemical physics (Print). 2012, Vol 14, Num 43, pp 14898-14904, issn 1463-9076, 7 p.Article

Un modèle chimique de l'aromaticité = Chemical model of aromaticityGASTMANS, J. P; GASTMANS, D. F; LOPES, J. M et al.Bulletin de la Société chimique de France. 1983, Num 9-10, pp II.274-II.276, issn 0037-8968Article

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