Water surface is acidic V Buch, A Milet, R Vácha, P Jungwirth, JP Devlin
Proceedings of the National Academy of Sciences 104 (18), 7342-7347, 2007
436 2007 Autoionization at the surface of neat water: is the top layer pH neutral, basic, or acidic? R Vácha, V Buch, A Milet, JP Devlin, P Jungwirth
Physical Chemistry Chemical Physics 9 (34), 4736-4747, 2007
208 2007 Silver versus gold catalysis in tandem reactions of carbonyl functions onto alkynes: A versatile access to furoquinoline and pyranoquinoline cores T Godet, C Vaxelaire, C Michel, A Milet, P Belmont
Chemistry–A European Journal 13 (19), 5632-5641, 2007
196 2007 Redox control of rotary motions in ferrocene-based elemental ball bearings A Iordache, M Oltean, A Milet, F Thomas, B Baptiste, E Saint-Aman, ...
Journal of the American Chemical Society 134 (5), 2653-2671, 2012
142 2012 Anisotropic intermolecular interactions in van der Waals and hydrogen-bonded complexes: What can we get from density functional calculations? A Milet, T Korona, R Moszynski, E Kochanski
The Journal of chemical physics 111 (17), 7727-7735, 1999
118 1999 Hydrogen bonding in water clusters: Pair and many-body interactions from symmetry-adapted perturbation theory A Milet, R Moszynski, PES Wormer, A van der Avoird
The Journal of Physical Chemistry A 103 (34), 6811-6819, 1999
113 1999 Theoretical study of the protolytic dissociation of HCl in water clusters A Milet, C Struniewicz, R Moszynski, PES Wormer
The Journal of chemical physics 115 (1), 349-356, 2001
107 2001 Synthesis and Theoretical Studies of a Diorganohydridoplatinum(IV) Complex, PtHMe2 {(pz)3 BH-N ,N‘ ,N‘‘ } ([(pz)3 BH]- = Tris(pyrazol-1-yl)borate) AJ Canty, A Dedieu, H Jin, A Milet, MK Richmond
Organometallics 15 (12), 2845-2847, 1996
99 1996 Regiochemistry in the Pauson− Khand Reaction: Has a Trans Effect Been Overlooked? F Robert, A Milet, Y Gimbert, D Konya, AE Greene
Journal of the American Chemical Society 123 (23), 5396-5400, 2001
98 2001 Theoretical Study of the Regiochemistry-Determining Step of the Pauson− Khand Reaction TJM de Bruin, A Milet, F Robert, Y Gimbert, AE Greene
Journal of the American Chemical Society 123 (29), 7184-7185, 2001
88 2001 On early events in the Pauson− Khand reaction Y Gimbert, D Lesage, A Milet, F Fournier, AE Greene, JC Tabet
Organic Letters 5 (22), 4073-4075, 2003
85 2003 Viologen-based redox-switchable anion-binding receptors R Kannappan, C Bucher, E Saint-Aman, JC Moutet, A Milet, M Oltean, ...
New Journal of Chemistry 34 (7), 1373-1386, 2010
81 2010 Theoretical study of the addition of hydrogen cyanide to methanimine in the gas phase and in aqueous solution R Arnaud, C Adamo, M Cossi, A Milet, Y Vallee, V Barone
Journal of the American Chemical Society 122 (2), 324-330, 2000
74 2000 Insight into the Reactivity of Olefins in the Pauson− Khand Reaction TJM de Bruin, A Milet, AE Greene, Y Gimbert
The Journal of Organic Chemistry 69 (4), 1075-1080, 2004
73 2004 Comment on Autoionization at the surface of neat water: is the top layer pH neutral, basic, or acidic? by R. Vácha, V. Buch, A. Milet, JP Devlin and P. Jungwirth, Phys. Chem … JK Beattie
Physical Chemistry Chemical Physics 10 (2), 330-331, 2008
71 2008 Structure and properties of the weakly bound trimer observed by rotational spectroscopy Z Kisiel, E Białkowska-Jaworska, L Pszczółkowski, A Milet, C Struniewicz, ...
The Journal of Chemical Physics 112 (13), 5767-5776, 2000
69 2000 Structural, Kinetic, and Theoretical Studies on Models of the Zinc‐Containing Phosphodiesterase Active Center: Medium‐Dependent Reaction Mechanisms K Selmeczi, C Michel, A Milet, I Gautier‐Luneau, C Philouze, JL Pierre, ...
Chemistry–A European Journal 13 (32), 9093-9106, 2007
61 2007 Solvation of the hydroxide anion: A combined DFT and molecular dynamics study Wei, EI Proynov, A Milet, DR Salahub
The Journal of Physical Chemistry A 104 (11), 2384-2395, 2000
57 2000 Free Energy ab Initio Metadynamics: A New Tool for the Theoretical Study of Organometallic Reactivity? Example of the C−C and C−H Reductive Eliminations … C Michel, A Laio, F Mohamed, M Krack, M Parrinello, A Milet
Organometallics 26 (5), 1241-1249, 2007
54 2007 σ-Bond Metathesis Reactions Involving Palladium (II) Hydride and Methyl Complexes: A Theoretical Assessment A Milet, A Dedieu, G Kapteijn, G Van Koten
Inorganic chemistry 36 (15), 3223-3231, 1997
54 1997