Alikhani ME - Search Results

1

Unimolecular decomposition of methyl ketene and its dimer in the gas phase: theory and experiment.

Derbali I, Hrodmarsson HR, Schwell M, Bénilan Y, Poisson L, Hochlaf M, Alikhani ME, Guillemin JC, Zins EL. Derbali I, et al. Among authors: alikhani me. Phys Chem Chem Phys. 2020 Sep 23;22(36):20394-20408. doi: 10.1039/d0cp03921g. Phys Chem Chem Phys. 2020. PMID: 32914152 Free article.

2

The Ni + O2 reaction: a combined IR matrix isolation and theoretical study of the formation and structure of NiO2.

Allouti F, Manceron L, Alikhani ME. Allouti F, et al. Among authors: alikhani me. Phys Chem Chem Phys. 2006 Jan 28;8(4):448-55. doi: 10.1039/b513038g. Epub 2005 Nov 21. Phys Chem Chem Phys. 2006. PMID: 16482286

3

Activation of C-H and B-H bonds through agostic bonding: an ELF/QTAIM insight.

Zins EL, Silvi B, Alikhani ME. Zins EL, et al. Among authors: alikhani me. Phys Chem Chem Phys. 2015 Apr 14;17(14):9258-81. doi: 10.1039/c4cp05728g. Epub 2015 Mar 11. Phys Chem Chem Phys. 2015. PMID: 25760795

4

Topological insights into the 1/1 diacetyl/water complex gained using a new methodological approach.

Dargent D, Zins EL, Madebène B, Alikhani ME. Dargent D, et al. Among authors: alikhani me. J Mol Model. 2015 Aug;21(8):214. doi: 10.1007/s00894-015-2751-9. Epub 2015 Jul 30. J Mol Model. 2015. PMID: 26224601

5

Characterization of B-H agostic compounds involved in the dehydrogenation of amine-boranes by group 4 metallocenes.

Zhu J, Zins EL, Alikhani ME. Zhu J, et al. Among authors: alikhani me. J Mol Model. 2016 Dec;22(12):294. doi: 10.1007/s00894-016-3165-z. Epub 2016 Nov 25. J Mol Model. 2016. PMID: 27888405

6

Conformational Landscape of the 1/1 Diacetyl/Water Complex Investigated by Infrared Spectroscopy and ab Initio Calculations.

Dargent D, Madebène B, Soulard P, Tremblay B, Zins EL, Alikhani ME, Asselin P. Dargent D, et al. Among authors: alikhani me. J Phys Chem A. 2017 Jan 12;121(1):88-97. doi: 10.1021/acs.jpca.6b10492. Epub 2016 Dec 21. J Phys Chem A. 2017. PMID: 27959532

7

Linear, Trinuclear Cobalt Complexes with o-Phenylene-bis-Silylamido Ligands.

Monakhov KY, van Leusen J, Kögerler P, Zins EL, Alikhani ME, Tromp M, Danopoulos AA, Braunstein P. Monakhov KY, et al. Among authors: alikhani me. Chemistry. 2017 May 11;23(27):6504-6508. doi: 10.1002/chem.201700496. Epub 2017 Apr 19. Chemistry. 2017. PMID: 28324628

8

Dehydrocoupling of dimethylamine borane by titanocene: elucidation of ten years of inconsistency between theoretical and experimental descriptions.

Zhu J , Zins EL , Alikhani ME . Zhu J , et al. Among authors: alikhani me. Phys Chem Chem Phys. 2018 Jun 13;20(23):15687-15695. doi: 10.1039/c8cp01970c. Phys Chem Chem Phys. 2018. PMID: 29846373

9

What is the hydrophobic interaction contribution to the stabilization of micro-hydrated complexes of trimethylamine oxide (TMAO)? A joint DFT-D, QTAIM, and MESP study.

Derbali I, Zins EL, Alikhani ME. Derbali I, et al. Among authors: alikhani me. J Mol Model. 2019 Nov 26;25(12):363. doi: 10.1007/s00894-019-4217-y. J Mol Model. 2019. PMID: 31773281

10

Vibrational spectra and structure of CH3Cl:NO complex: IR matrix isolation and DFT study.

Dozova N, Krim L, Alikhani ME, Lacome N. Dozova N, et al. Among authors: alikhani me. J Phys Chem A. 2005 Dec 8;109(48):10880-5. doi: 10.1021/jp053894o. J Phys Chem A. 2005. PMID: 16331931

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