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| Issue | Title | |
| Vol 5, No 1 (2014) | Sensor properties of carboxyl-modifies carbon nanotubes | Abstract PDF (Eng) similar documents |
| N. P. Polikarpova, I. V. Zaporotskova, D. E. Vilkeeva, D. I. Polikarpov | ||
| "... carboxyl group chemical activity is defined. The research is performed by the MNDO method within ..." | ||
| Vol 9, No 1 (2018) | Sensitivity of carboxyl-modified carbon nanotubes to alkaline metals | Abstract PDF (Eng) similar documents |
| N. P. Boroznina, I. V. Zaporotskova, S. V. Boroznin | ||
| "... carbon nanotubes. The possibility of using nanotubes modified by carboxyl group for detection of alkaline ..." | ||
| Vol 7, No 1 (2016): Special Issue: Proceedings of the 12th Biennial International Conference “Advanced Carbon Nanostructures” (ACNS’2015) | Phenomenology of ripples in graphene | Abstract PDF (Eng) similar documents |
| S. A. Ktitorov, R. I. Mukhamadiarov | ||
| Vol 7, No 3 (2016) | Functional equations for the Potts model with competing interactions on a Cayley tree | Abstract PDF (Eng) similar documents |
| G. I. Botirov | ||
| "... In this paper, we consider an infinite system of functional equations for the Potts model ..." | ||
| Vol 7, No 3 (2016) | Development of an orbital-free approach for simulation of multi-atomic nanosystems with covalent bonds | Abstract PDF (Eng) similar documents |
| V. G. Zavodinsky, O. A. Gorkusha | ||
| "... version of the density functional theory may be used for finding equilibrium configurations of multi ..." | ||
| Vol 6, No 4 (2015) | Renormalization group in the infinite-dimensional turbulence: determination of the RG-functions without renormalization constants | Abstract PDF (Eng) similar documents |
| L. Ts. Adzhemyan, T. L. Kim, M. V. Kompaniets, V. K. Sazonov | ||
| "... We calculate renormalization-group functions in the developed turbulence model for infinite ..." | ||
| Vol 3, No 3 (2012) | Symmetrized combinations of s-, p-, d-, f-spinors for study of electronic structure of physical systems | Abstract similar documents |
| V. P. Smirnov | ||
| "... and double point groups with axes up to six order. ..." | ||
| Vol 3, No 1 (2012) | The influence functional approach for a description of the nanosystems dynamics | Abstract similar documents |
| A. A. Biryukov, M. A. Shleenkov | ||
| "... In the functional integration formalism and the influence functional approach we derive formulas ..." | ||
| Vol 14, No 3 (2023) | Stable hydrosol prepared by deaggregation from laser synthesis nanodiamond | Abstract PDF (Eng) similar documents |
| A. E. Aleksenskii, M. V. Baidakova, A. D. Trofimuk, B. B. Tudupova, A. S. Chizhikova, A. V. Shvidchenko | ||
| Vol 10, No 4 (2019) | On a possibility to develop a full-potential orbital-free modeling approach | Abstract PDF (Eng) similar documents |
| V. G. Zavodinsky, O. A. Gorkusha | ||
| Vol 6, No 3 (2015) | Classical density functional approach to adsorption of hydrogen in carbon materials | Abstract PDF (Eng) similar documents |
| V. V. Zubkov, V. M. Samsonov, I. V. Grinev, I. V. Popov | ||
| "... .33, 77, 200 and 300 K) over a wide range of pressures using the classical density functional theory ..." | ||
| Vol 14, No 4 (2023) | Irreducible characters of the icosahedral group | Abstract PDF (Eng) similar documents |
| S. Kanemitsu, J. Mehta, Y. Sun | ||
| "... To study point groups, their irreducible characters are essential. The table of irreducible ..." | ||
| Vol 4, No 2 (2013) | Effect of anchoring atoms on transport properties of a carbon-dimer based molecular junction: a first principles study | Abstract PDF (Eng) similar documents |
| R. M. Hariharan, D. John Thiruvadigal | ||
| "... and the probing electrodes. Combining the density functional theory calculations (DFT) for molecular electronic ..." | ||
| Vol 2, No 4 (2011) | Attractive or repulsive Casimir effect and boundary conditions | Abstract PDF (Eng) similar documents |
| M. Asorey, J.M. Mu˜noz-Casta˜neda | ||
| "... group flow. The conformal invariant boundary conditions which do not generate a Casimir force have ..." | ||
| Vol 15, No 4 (2024) | Diameter dependent geometrical and electrical properties of zigzag HgSe nanotubes: A density functional study. | Abstract PDF (Eng) similar documents |
| M. Das | ||
| "... Using density functional theory, evolution of geometrical and electrical properties like wall ..." | ||
| Vol 10, No 4 (2019) | The prediction of COOH functionalized carbon nanotube application in melphalan drug delivery | Abstract PDF (Eng) similar documents |
| Hadi Lari, Ali Morsali, Mohammad Momen Heravi | ||
| "... (if the noncovalent functionalization is desired). The OH and NH2 groups of melphalan may bond to Cl (COCl mechanism ..." | ||
| Vol 7, No 4 (2016) | In4Mg3 in InxMg3 (x = 1 − 6) series: a magic unit for future smart materials | Abstract PDF (Eng) similar documents |
| D. R. Roy, M. Shaikh, V. Kumar | ||
| "... and/or unusually stable motifs. A very popular hybrid exchange-correlation functional, B3LYP as proposed by A. D ..." | ||
| Vol 11, No 1 (2020) | Magnetoelectric effects theory by Heisenberg method based on permutation group symmetry of nanoparticles | Abstract PDF (Eng) similar documents |
| S. Leble | ||
| "... are expressed via characters of irreducible representations of corresponding permutation groups by the Heitler ..." | ||
| Vol 7, No 5 (2016) | Characterization of the normal subgroups of finite index for the group representation of a Cayley tree | Abstract PDF (Eng) similar documents |
| F. H. Haydarov | ||
| "... In this paper we give a characterization of normal subgroups for the group representation ..." | ||
| Vol 15, No 5 (2024) | Magnesium based tin-silicon alloys under pressure: first-principles evolution search results | Abstract PDF (Eng) similar documents |
| Yuri V. Luniakov | ||
| "... the evolution algorithm combined with the density functional theory (DFT) approach. The evolutionary search has ..." | ||
| Vol 16, No 4 (2025) | Surface electronic structure of TbIr2Si2 antiferromagnet | Abstract PDF (Eng) similar documents |
| D. A. Perminova, I. A. Shvets, D. Yu. Usachov, D. V. Vyalykh, S. V. Eremeev | ||
| "... By means of ab initio density functional theory (DFT) calculations, we examined the surface ..." | ||
| Vol 4, No 3 (2013) | The effects of defects on electron transport in metallic single wall carbon nanotubes | Abstract PDF (Eng) similar documents |
| S. Sivasathya, D. John Thiruvadigal | ||
| "... with the density functional theory (DFT). The transmission spectra and the projected density of states ..." | ||
| Vol 7, No 6 (2016) | Development of the orbital-free approach for hetero-atomic systems | Abstract PDF (Eng) similar documents |
| V. G. Zavodinsky, O. A. Gorkusha | ||
| "... for hetero-atomic systems. In this work, we used the mono-atomic functionals of kinetic energy to construct ..." | ||
| Vol 12, No 3 (2021) | Personalized energy systems based on nanostructured materials | Abstract PDF (Eng) similar documents |
| A. N. Kovalenko, E. A. Tugova, V. I. Popkov, O. N. Karpov, A. I. Klyndyuk | ||
| "... nanostructured materials with special functional properties for personalized energy systems development ..." | ||
| Vol 9, No 5 (2018) | Thermodynamics and kinetics of non-autonomous phase formation in nanostructured materials with variable functional properties | Abstract similar documents |
| A. N. Kovalenko, E. A. Tugova | ||
| "... ) mechanisms and formation, as well as methods of their control in order to achieve the desired functional ..." | ||
| Vol 9, No 3 (2018) | Possibility of drug delivery due to hydrogen bonds formation in nanodiamonds and doxorubicin: molecular modeling | Abstract PDF (Eng) similar documents |
| A. N. Bokarev, I. L. Plastun | ||
| "... simulation. Using molecular modeling by the density functional theory method with the B3LYP functional ..." | ||
| 1 - 26 of 26 Items | ||
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