Self-consistent second-order Green’s function perturbation theory for periodic systems von Rusakov, Alexander A., Zgid, Dominika

Volltext

Comment on “Potential Energy Surface of Group 11 Trimers (Cu, Ag, Au): Bond Angle Isomerism in Au3” von Rusakov, Alexander A.

Volltext

Self-Energy Embedding Theory (SEET) for Periodic Systems von Rusakov, Alexander A, Iskakov, Sergei, Tran, Lan Nguyen, Zgid, Dominika

Volltext

Exploring connections between statistical mechanics and Green’s functions for realistic systems: Temperature dependent electronic entropy and internal energy from a self-consistent... von Welden, Alicia Rae, Rusakov, Alexander A., Zgid, Dominika

Volltext

Uncovering chemical homology of superheavy elements: a close look at astatine von Demidov, Yuriy A, Shalaevsky, Alexander A, Oleynichenko, Alexander V, Rusakov, Alexander A

Volltext

Local Hamiltonians for quantitative Green's function embedding methods von Rusakov, Alexander A, Phillips, Jordan J, Zgid, Dominika

Volltext

Integrated Study of the Thiocyanate Anion Electrooxidation by Electroanalytical and Computational Methods von Kozyrev, Yuriy N., Mendkovich, Andrey S., Kokorekin, Vladimir A., Luzhkov, Victor B., Rusakov, Alexander I.

Volltext

Novel Computational Chemistry Infrastructure for Simulating Astatide in Water: From Basis Sets to Force Fields Using Particle Swarm Optimization von Rueda Espinosa, Kennet J., Kananenka, Alexei A., Rusakov, Alexander A.

Volltext

Effect of propagator renormalization on the band gap of insulating solids von Iskakov, Sergei, Rusakov, Alexander A., Zgid, Dominika, Gull, Emanuel

Volltext

Investigating the Heaviest Halogen: Lessons Learned from Modeling the Electronic Structure of Astatine’s Small Molecules von Casetti, Vincent T., MacLean, James, Ayoub, Adam D., Fredericks, Rain J., Adamski, Jacob A., Rusakov, Alexander A.

Volltext

Arsenic, cadmium, mercury, and lead levels in hair and urine in first-year RUDN University students of different geographic origins von Kirichuk, Anatoly A., Skalny, Andrey A., Rusakov, Alexander I., Tinkov, Alexey A., Skalny, Anatoly V.

Volltext

Chebyshev polynomial representation of imaginary-time response functions von Gull, Emanuel, Iskakov, Sergei, Krivenko, Igor, Rusakov, Alexander A, Zgid, Dominika

Volltext

Bent naphthodithiophenes: synthesis and characterization of isomeric fluorophores von Adusei, Emmanuel B. A, Casetti, Vincent T, Goldsmith, Calvin D, Caswell, Madison, Alinj, Drecila, Park, Jimin, Zeller, Matthias, Rusakov, Alexander A, Kinney, Zacharias J

Volltext

Comment on “Potential Energy Surface of Group 11 Trimers (Cu, Ag, Au): Bond Angle Isomerism in Au 3 ” von Rusakov, Alexander A.

Volltext

Estimating the adsorption energy of element 113 on a gold surface von Rusakov, Alexander A., Demidov, Yuriy A., Zaitsevskii, Andréi

Volltext

Kinetics and thermodynamics of reversible disproportionation-comproportionation in redox triad oxoammonium cations - nitroxyl radicals - hydroxylamines von Sen', Vasily D., Tikhonov, Ivan V., Borodin, Leonid I., Pliss, Evgeny M., Golubev, Valery A., Syroeshkin, Mikhail A., Rusakov, Alexander I.

Volltext

Electroreduction mechanism of N-phenylhydroxylamines in aprotic solvents: N-(2-nitrophenyl)- and N-(3-nitrophenyl)hydroxylamines von Mendkovich, Andrey S., Syroeshkin, Mikhail A., Nasybullina, Darya V., Mikhailov, Mikhail N., Gultyai, Vadim P., Rusakov, Alexander I.

Volltext

Space group symmetry applied to SCF calculations with periodic boundary conditions and Gaussian orbitals von Rusakov, Alexander A, Frisch, Michael J, Scuseria, Gustavo E

Volltext

Effect of the structure of nitroxyl radicals on the kinetics of their acid-catalyzed disproportionation von Tikhonov, Ivan V., Sen', Vasily D., Borodin, Leonid I., Pliss, Evgeny M., Golubev, Valery A., Rusakov, Alexander I.

Volltext

Montenegrin-Albanian Linguistic Border: In Search of “Balanced Language Contact” von Morozova, Maria S., Rusakov, Alexander Yu

Volltext