Otilia Mo
Otilia Mo
Verified email at uam.es
Title
Cited by
Cited by
Year
Cooperative (nonpairwise) effects in water trimers: An ab initio molecular orbital study
O Mó, M Yáńez, J Elguero
The Journal of chemical physics 97 (9), 6628-6638, 1992
4251992
Computational chemistry: A useful (sometimes mandatory) tool in mass spectrometry studies
M Alcamí, O Mó, M Yáńez
Mass spectrometry reviews 20 (4), 195-245, 2001
2082001
Study of the methanol trimer potential energy surface
O Mó, M Yanez, J Elguero
The Journal of chemical physics 107 (9), 3592-3601, 1997
1461997
Beryllium bonds, do they exist?
M Yanez, P Sanz, O Mo, I Alkorta, J Elguero
Journal of chemical theory and computation 5 (10), 2763-2771, 2009
1432009
Resonance-assisted hydrogen bonds: a critical examination. structure and stability of the enols of β-diketones and β-enaminones
P Sanz, O Mo, M Yanez, J Elguero
The Journal of Physical Chemistry A 111 (18), 3585-3591, 2007
1412007
High level ab initio and density functional theory studies on methanol–water dimers and cyclic trimer
L González, O Mó, M Yáńez
The Journal of chemical physics 109 (1), 139-150, 1998
1411998
Competition between X⊙⊙⊙ H⊙⊙⊙ Y Intramolecular Hydrogen Bonds and X⊙⊙⊙⊙ Y (X= O, S, and Y= Se, Te) Chalcogen− Chalcogen Interactions
P Sanz, M Yáńez, O Mó
The Journal of Physical Chemistry A 106 (18), 4661-4668, 2002
1302002
Cooperative effects in the cyclic trimer of methanol. An ab initio molecular orbital study
O Mó, M Yánez, J Elguero
Journal of Molecular Structure: THEOCHEM 314 (1-2), 73-81, 1994
1301994
High‐level ab initio versus DFT calculations on (H2O2) 2 and H2O2–H2O complexes as prototypes of multiple hydrogen bond systems
L González, O Mó, M Yáńez
Journal of computational chemistry 18 (9), 1124-1135, 1997
1291997
Do coupling constants and chemical shifts provide evidence for the existence of resonance-assisted hydrogen bonds?
I Alkorta, J Elguero, O Mó, M Yáńez*, JE Del Bene
Molecular Physics 102 (23-24), 2563-2574, 2004
1262004
Density functional theory study on ethanol dimers and cyclic ethanol trimers
L González, O Mó, M Yáńez
The Journal of chemical physics 111 (9), 3855-3861, 1999
1201999
Very strong hydrogen bonds in neutral molecules: the phosphinic acid dimers
L González, O Mó, M Yáńez, J Elguero
The Journal of chemical physics 109 (7), 2685-2693, 1998
1151998
Are resonance-assisted hydrogen bonds ‘resonance assisted’? A theoretical NMR study
I Alkorta, J Elguero, O Mó, M Yáńez, JE Del Bene
Chemical physics letters 411 (4-6), 411-415, 2005
1112005
High-level ab initio calculations on the intramolecular hydrogen bond in thiomalonaldehyde
L González, O Mó, M Yáńez
The Journal of Physical Chemistry A 101 (50), 9710-9719, 1997
1081997
Cu+ binding energies. Dramatic failure of the G2 method vs. good performance of the B3LYP approach
A Luna, M Alcamı, O Mó, M Yanez
Chemical Physics Letters 320 (1-2), 129-138, 2000
1032000
The geometry of pyrazole: A test for ab initio calculations
AL Llamas‐Saiz, C Foces‐Foces, O Mó, M Yáńez, E Elguero, J Elguero
Journal of computational chemistry 16 (3), 263-272, 1995
991995
Ab initio study of the structural, energetic, bonding, and IR spectroscopic properties of complexes with dihydrogen bonds
I Alkorta, J Elguero, O Mó, M Yáńez, JE Del Bene
The Journal of Physical Chemistry A 106 (40), 9325-9330, 2002
982002
Cooperative effects in water trimers. The performance of density functional approaches
L González, O Mó, M Yáńez, J Elguero
Journal of Molecular Structure: THEOCHEM 371, 1-10, 1996
941996
Protonation energies and tautomerism of azoles. Basis set effects
O Mo, JLG De Paz, M Yanez
The Journal of Physical Chemistry 90 (22), 5597-5604, 1986
921986
Bonding in Tropolone, 2‐Aminotropone, and Aminotroponimine: No Evidence of Resonance‐Assisted Hydrogen‐Bond Effects
P Sanz, O Mó, M Yáńez, J Elguero
Chemistry–A European Journal 14 (14), 4225-4232, 2008
902008
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