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  1. Marenich, Aleksandr V.; Yong, Pei-Han; Bersuker, Isaac B.; Boggs, James E. Quantitative antidiabetic activity prediction for the class of guanidino- and aminoguanidinopropionic acid analogues based on electron-conformational studies. Journal of Chemical Information and Modeling (2008), 48, 556-568. Link
  2. Marenich, Aleksandr V.; Olson, Ryan M.; Chamberlin, Adam C.; Cramer, Christopher J.; Truhlar, Donald G. Polarization effects in aqueous and nonaqueous solutions. Journal of Chemical Theory and Computation (2007), 3, 2055-2067. Link
  3. Olson, Ryan M.; Marenich, Aleksandr V.; Cramer, Christopher J.; Truhlar, Donald G. Charge Model 4 and intramolecular charge polarization. Journal of Chemical Theory and Computation (2007), 3, 2046-2054. Link
  4. Marenich, Aleksandr V.; Olson, Ryan M.; Kelly, Casey P.; Cramer, Christopher J.; Truhlar, Donald G. Self-consistent reaction field model for aqueous and nonaqueous solutions based on accurate polarized partial charges. Journal of Chemical Theory and Computation (2007), 3, 2011-2033. Link
  5. Marenich, Aleksandr V.; Boggs, James E. Molecular spectroscopy beyond the Born-Oppenheimer approximation: a computational study of the CF3O and CF3S radicals. Journal of Physical Chemistry A (2007), 111, 11214-11220. Link
  6. Jaque, Pablo; Marenich, Aleksandr V.; Cramer, Christopher J.; Truhlar, Donald G. Computational electrochemistry: the aqueous Ru3+|Ru2+ reduction potential. Journal of Physical Chemistry C (2007), 111, 5783-5799. Link
  7. Marenich, Aleksandr V.; Boggs, James E. Equation-of-motion coupled-cluster study of Jahn-Teller effect in X2E CF3O* and CF3S*. International Journal of Quantum Chemistry (2006), 106, 2609-2616. Link
  8. Marenich, Aleksandr V.; Boggs, James E. The molecular structure, spin-vibronic energy levels, and thermochemistry of CH3O*. Journal of Molecular Structure (2006), 780-781, 163-170. Link
  9. Marenich, Aleksandr V.; Boggs, James E. Ab initio study of spin-vibronic dynamics in the ground X2E and excited A2A1 electronic states of CH3S*. Journal of Chemical Theory and Computation (2005), 1, 1162-1171. Link
  10. Marenich, Aleksandr V.; Boggs, James E. The role of the cubic and quartic Jahn-Teller coupling in the X2E ground electronic state of the methoxy radical CH3O. Chemical Physics Letters (2005), 404, 351-355. Link
  11. Marenich, Aleksandr V.; Boggs, James E. A model spin-vibronic Hamiltonian for twofold degenerate electron systems: A variational ab initio study of X2E CH3O*. Journal of Chemical Physics (2005), 122, 024308. Link
  12. Marenich, Aleksandr V.; Boggs, James E. Jahn-Teller effect versus spin-orbit coupling in X2E CH3S: An ab initio study by the equation-of-motion coupled cluster method and multiconfiguration quasi-degenerate second-order perturbation theory. Journal of Physical Chemistry A (2004), 108, 10594-10601. Link
  13. Marenich, Aleksandr V.; Boggs, James E. Vibrational spectrum and thermochemistry of the formyl (HCO) radical: A variational study by the coupled cluster CCSD(T) method with complete basis set extrapolation. Journal of Physical Chemistry A (2004), 108, 5431-5437. Link
  14. Marenich, Aleksandr V.; Boggs, James E. Structural and thermochemical properties of the hydroxymethyl (CH2OH) radical: a high precision ab initio study. Journal of Chemical Physics (2003), 119, 10105-10114. Link
  15. Marenich, Aleksandr V.; Boggs, James E. A variational study of nuclear dynamics and structural flexibility of the CH2OH radical. Journal of Chemical Physics (2003), 119, 3098-3105. Link
  16. Marenich, A. V.; Solomonik, V. G. Nonempirical study of nuclear dynamics in nonrigid LiReO4 and K2SO4 molecules. Journal of Structural Chemistry (Translation of Zhurnal Strukturnoi Khimii) (2002), 43, 899-907. Link
  17. Marenich, A. V.; Solomonik, V. G. Ab initio description of nuclear motion in nonrigid MkXYn (k>=1) molecules with quasirigid XYn fragments. Journal of Structural Chemistry (Translation of Zhurnal Strukturnoi Khimii) (2002), 43, 891-898. Link
  18. Marenich, Aleksandr V.; Boggs, James E. Coupled cluster CCSD(T) calculations of equilibrium geometries, anharmonic force fields, and thermodynamic properties of the formyl (HCO) and isoformyl (COH) radical species. Journal of Physical Chemistry A (2003), 107, 2343-2350. Link
  19. Solomonik, V. G.; Marenich, A. V. Isomerism and vibration spectra of M2XO4 molecules (M = Li, Na, K; X = S, Se, Te, Cr, Mo, W). Russian Journal of General Chemistry (Translation of Zhurnal Obshchei Khimii) (2002), 72, 717-728. Link
  20. Solomonik, V. G.; Marenich, A. V. Isomerism and vibrational spectra of alkali metal perrhenates: Ab initio CISD+Q calculations. Journal of Structural Chemistry (Translation of Zhurnal Strukturnoi Khimii) (2001), 42, 914-919.
  21. Marenich, A. V.; Solomonik, V. G. The structures, force fields, and vibrational spectra of XO42- ions (X = S, Se, Te, Cr, Mo, W): ab initio CISD+Q calculations. Zhurnal Neorganicheskoi Khimii (2001), 46, 462-466.
  22. Solomonik, V. G.; Marenich, A. V. Isomerism and vibrational spectra of alkali metal tungstate molecules. Zhurnal Fizicheskoi Khimii (2000), 74, 94-102.
  23. Marenich, A. V.; Solomonik, V. G. Structure and vibrational spectra of XO2 molecules and XO32- ions (X = S, Se and Te). Zhurnal Fizicheskoi Khimii (1999), 73, 2205-2210.
  24. Solomonik, V. G.; Marenich, A. V. Ab initio study of the structure, force fields, and vibrational spectra of alkali metal tellurites. Journal of Structural Chemistry (Translation of Zhurnal Strukturnoi Khimii) (1999), 40, 358-367.
  25. Solomonik, V. G.; Marenich, A. V.; Sliznev, V. V. Ab initio studies on the structure and vibrational spectra of alkali-metal sulfites and selenites. Russian Journal of Coordination Chemistry (Translation of Koordinatsionnaya Khimiya) (1998), 24, 457-466.