Atomic basis functions for molecular electronic structure calculations von Laikov, Dimitri N.

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Optimization of atomic density-fitting basis functions for molecular two-electron integral approximations von Laikov, Dimitri N.

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Additive atomic approximation for relativistic effects: A two-component Hamiltonian for molecular electronic structure calculations von Laikov, Dimitri N.

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Simple exchange hole models for long-range-corrected density functionals von Laikov, Dimitri N.

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A reversible numerical integrator of the isokinetic equations of motion von Laikov, Dimitri N.

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A new parametrizable model of molecular electronic structure von Laikov, Dimitri N.

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A new class of atomic basis functions for accurate electronic structure calculations of molecules von Laikov, Dimitri N.

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Atomic effective potentials for starting molecular electronic structure calculations von Laikov, Dimitri N., Briling, Ksenia R.

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Control of Photoisomerization of an Azoazacryptand by Anion Binding and Cucurbit[8]uril Encapsulation in an Aqueous Solution von Oshchepkov, Aleksandr S, Namashivaya, Siva S. R, Khrustalev, Victor N, Hampel, Frank, Laikov, Dimitri N, Kataev, Evgeny A

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Penrose nanotiles: design of the thin and thick rhomb molecules to self-assemble into a quasicrystal von Laikov, Dimitri N.

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Ullmann-type C–Se Cross-Coupling in the Hydantoin Family: Synthesis, Mechanistic Studies, and Tests of Biological Activity von Vyhivskyi, Oleksandr, Laikov, Dimitri N, Finko, Alexander V, Skvortsov, Dmitry A, Zhirkina, Irina V, Tafeenko, Victor A, Zyk, Nikolay V, Majouga, Alexander G, Beloglazkina, Elena K

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Neglect of four- and approximation of one-, two-, and three-center two-electron integrals in a symmetrically orthogonalized basis von Laikov, Dimitri N.

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Inclusion of second-order correlation effects for the ground and singly-excited states suitable for the study of conical intersections: The CIS(2) model von Laikov, Dimitri, Matsika, Spiridoula

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Synthesis and biological activity of 5-aryliden-2-thiohydantoin S-aryl derivatives von Finko, Alexander V., Skvortsov, Dmitry A., Laikov, Dimitri N., Averochkin, Gleb M., Dlin, Egor A., Kalinina, Marina A., Aladinskiy, Vladimir A., Vorobyeva, Nataliya S., Mironov, Andrei V., Beloglazkina, Elena K., Zyk, Nikolay V., Ivanenkov, Yan A., Majouga, Alexander G.

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Communication: Stabilization of radical anions with weakly bound electron in condensed media: A case study of diacetonyl radical anion von Saenko, Elizaveta V., Laikov, Dimitri N., Baranova, Irina A., Feldman, Vladimir I.

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Intrinsic minimal atomic basis representation of molecular electronic wavefunctions von Laikov, Dimitri N.

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High-resolution electron spin resonance spectroscopy of XeF in solid argon. The hyperfine structure constants as a probe of relativistic effects in the chemical bonding properties... von Misochko, Eugenii Ya, Akimov, Alexander V, Goldschleger, Ilya U, Tyurin, Danil A, Laikov, Dimitri N

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An Unusual Domino Retro-Ene-Conia Reaction: Regio- and Stereoselective One-Carbon Ring Expansion of Fenchol Derivatives von Rüedi, Georg, Laikov, Dimitri N., Hansen, Hans-Jürgen

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Reactions of excess electrons with “bridged” amidoesters in low-temperature matrices von Saenko, Elizaveta V., Laikov, Dimitri N., Feldman, Vladimir I.

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IR-spectroscopic manifestation of the diacetyl radical anion produced by irradiation of diacetyl in a dimethyl ether matrix at 7K von Saenko, Elizaveta V., Laikov, Dimitri N., Feldman, Vladimir I.

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