| 1 |
A Hybrid Quantum Mechanical Approach: Intimate Details of Electron Transfer between Type-I CdSe/ZnS Quantum Dots and an Anthraquinone Molecule
Kaledin AL, Lian TQ, Hill CL, Musaev DG
Journal of Physical Chemistry B, 119(24), 7651, 2015 |
| 2 |
Synthesis, Structures, and Photochemistry of Tricarbonyl Metal Polyoxoanion Complexes, [X2W20O70{M(CO)(3)}(2)](12-) (X = Sb, Bi and M = Re, Mn)
Zhao CC, Kambara CS, Yang Y, Kaledin AL, Musaev DG, Lian TQ, Hill CL
Inorganic Chemistry, 52(2), 671, 2013 |
| 3 |
An Inorganic Chromophore Based on a Molecular Oxide Supported Metal Carbonyl Cluster: [P2W17O61{Re(CO)(3)}(3){ORb(H2O)}(mu(3)-OH)](9-)
Zhao CC, Rodriguez-Cordoba W, Kaledin AL, Yang Y, Geletii YV, Lian TQ, Musaev DG, Hill CL
Inorganic Chemistry, 52(23), 13490, 2013 |
| 4 |
Driving of a Small Solvated Peptide in the IR and THz Range-A Comparative Study of Energy Flow
Niehues G, Kaledin AL, Bowman JM, Havenith M
Journal of Physical Chemistry B, 116(33), 10020, 2012 |
| 5 |
The unique bonding characteristics of beryllium and the Group IIA metals
Heaven MC, Bondybey VE, Merritt JM, Kaledin AL
Chemical Physics Letters, 506(1-3), 1, 2011 |
| 6 |
Zero-point energy constrained quasiclassical, classical, and exact quantum simulations of isomerizations and radial distribution functions of the water trimer using an ab initio potential energy surface
Czako G, Kaledin AL, Bowman JM
Chemical Physics Letters, 500(4-6), 217, 2010 |
| 7 |
Insights into Photoinduced Electron Transfer between [Ru(bpy)(3)](2+) and [S2O8](2-) in Water: Computational and Experimental Studies
Kaledin AL, Huang ZQ, Geletii YV, Lian TQ, Hill CL, Musaev DG
Journal of Physical Chemistry A, 114(1), 73, 2010 |
| 8 |
Computational Studies of the Geometry and Electronic Structure of an All-Inorganic and Homogeneous Tetra-Ru-Polyoxotungstate Catalyst for Water Oxidation and Its Four Subsequent One-Electron Oxidized Forms
Quinonero D, Kaledin AL, Kuznetsov AE, Geletii YV, Besson C, Hill CL, Musaev DG
Journal of Physical Chemistry A, 114(1), 535, 2010 |
| 9 |
Insights into Photoinduced Electron Transfer Between [Ru(mptpy)(2)](4+) (mptpy=4'(4-methylpyridinio)-2,2':6',2''-terpyridine) and [S2O8](2-): Computational and Experimental Studies
Kaledin AL, Huang ZQ, Yin QS, Dunphy EL, Constable EC, Housecroft CE, Geletii YV, Lian TQ, Hill CL, Musaev DG
Journal of Physical Chemistry A, 114(21), 6284, 2010 |
| 10 |
Calculation of the Vibrational Spectra of H5O2+ and Its Deuterium-Substituted Isotopologues by Molecular Dynamics Simulations
Kaledin M, Kaledin AL, Bowman JM, Ding J, Jordan KD
Journal of Physical Chemistry A, 113(26), 7671, 2009 |
