Alexey L. Kaledin

Accurate <i>ab initio</i> and “hybrid” potential energy surfaces, intramolecular vibrational energies, and classical ir spectrum of the water dimer

Alex Shank, Yimin Wang, Alexey L. Kaledin et al. · The Journal of Chemical Physics · 2009 · 188 citations

Natural Sciences, Chemistry, Physics +17

Key Mechanistic Features of Enantioselective C–H Bond Activation Reactions Catalyzed by [(Chiral Mono-<i>N</i>-Protected Amino Acid)–Pd(II)] Complexes

Djamaladdin G. Musaev, Alexey L. Kaledin, Bing‐Feng Shi et al. · Journal of the American Chemical Society · 2011 · 170 citations

Natural Sciences, Chemistry, Medicinal Chemistry +15

Time averaging the semiclassical initial value representation for the calculation of vibrational energy levels

Alexey L. Kaledin, William H. Miller · The Journal of Chemical Physics · 2003 · 105 citations

Natural Sciences, Chemistry, Physics +17

Surface passivation extends single and biexciton lifetimes of InP quantum dots

Wenxing Yang, Yawei Yang, Alexey L. Kaledin et al. · Chemical Science · 2020 · 96 citations · Full text

Engineering, Materials Engineering, Materials Science +17

Vibrational Analysis of the H₅O₂⁺ Infrared Spectrum Using Molecular and Driven Molecular Dynamics

Martina Kaledin, Alexey L. Kaledin, Joel M. Bowman · The Journal of Physical Chemistry A · 2005 · 95 citations

Natural Sciences, Chemistry, Physics +17