Cover Image

Ab initio calculated structure of phonon spectra of calcium and cadmium apatites

Saved in:

Bibliographic Details
Date:	2011
Main Authors:	V. L. Karbivskyi, A. P. Soroka, Kh. Kasiianenko
Format:	Article
Language:	English
Published:	2011
Series:	Nanosystems, nanomaterials, nanotechnologies
Online Access:	http://jnas.nbuv.gov.ua/article/UJRN-0000473639
Tags:	Add Tag No Tags, Be the first to tag this record!
Journal Title:	Library portal of National Academy of Sciences of Ukraine \| LibNAS

Institution

Library portal of National Academy of Sciences of Ukraine | LibNAS

Similar Items

Atomic structure of calcium and cadmium apatites calculated ab initio
by: V. L. Karbovskij, et al.
Published: (2013)

First-principles study of electronic, atomic structures, phonon spectra and dielectric properties of calcium and cadmium apatites
by: Soroka, A.P., et al.
Published: (2015)

Features of electronic structure of phosphate and vanadate apatites of calcium and cadmium
by: A. P. Soroka, et al.
Published: (2015)

Atomic architecture of vanadate and arsenate apatites of calcium and cadmium
by: V. L. Karbovskij, et al.
Published: (2014)

Ab initio calculation of the equilibrium positions and electronic spectra of oxygen and carbon impurities in silicon
by: T. V. Horkavenko, et al.
Published: (2016)

Ab-initio calculations for the structural properties of Zr-Nb alloys
by: Kharchenko, V.O., et al.
Published: (2013)

Passivation of CdHgTe epitaxial structures: ab initio calculations
by: R. M. Balabai
Published: (2012)

Manifestation of intermolecular interactions in raman spectra and ab initio calculations of molecular aggregation in liquid ethylene glycol
by: F. H. Tukhvatullin, et al.
Published: (2014)

Manifestation of intermolecular interactions in raman spectra and ab initio calculations of molecular aggregation in liquid ethylene glycol
by: F. H. Tukhvatullin, et al.
Published: (2014)

The choice of silicon nanostructures for CH₄ detection: ab-initio calculation
by: Balabai, R.M., et al.
Published: (2014)

Molecular structure and interactions of nucleic acid components in nanoparticles: Ab initio calculations
by: Yu. V. Rubin, et al.
Published: (2012)

Molecular structure and interactions of nucleic acid components in nanoparticles: Ab initio calculations
by: Yu. V. Rubin, et al.
Published: (2012)

The choice of silicon nanostructures for CH4 detection: ab-initio calculation
by: R. M. Balabai, et al.
Published: (2014)

Ab initio study to stabilities of the nanodiamond
by: L. I. Ovsiannikova
Published: (2014)

Ab initio calculations of three-body interaction in cryocrystals under pressure
by: E. E. Gorbenko, et al.
Published: (2011)

Ab initio calculations of the electronic structure for Mn2+-doped YAlO3 crystals
by: S. Piskunov, et al.
Published: (2020)

Simulation of the antioxidant properties of melatonin on the results of ab initio quantum chemical calculations
by: Ju. Kuznetsova, et al.
Published: (2012)

Synthesis and investigation of phosphatoborates calcium with apatite-type structure
by: Yu. Strutynska, et al.
Published: (2014)

Electronic structure and the dielectric matrix of the model photonic crystals fabricated from fibres: ab initio calculations
by: R. M. Balabai, et al.
Published: (2015)

Ab Initio Calculation of Magnetic Interaction Between Edge Dislocation and Oxygen Impurity in Silicon
by: I. V. Pliushchai, et al.
Published: (2014)

The study of the structure and spectral properties of HOBr molecule by ab initio methods
by: E. M. Khomenko
Published: (2011)

How does one extract many-body interatomic potentials from ab-initio band structure calculations
by: Gurskii, Z., et al.
Published: (1999)

Electronic structure and excited-state properties of Co₂TiSn and Co₂ZrSn from ab initio calculations
by: Bekenov, L.V., et al.
Published: (2005)

Ab initio теория многочастичного взаимодействия в короткодействующем потенциале отталкивания
by: Троицкая, Е.П., et al.
Published: (2010)

Ab initio modeling of the amorphization process in a Fe–Zr system
by: I. V. Pliushchai, et al.
Published: (2015)

Comparative modeling of molecular interaction of glutathione and melatonin with hydroxyl-radicals to results of on ab initio quantum-chemical calculations
by: V. V. Solovev, et al.
Published: (2012)

Electronic Structure of NdMeO3 (Me = V, Ni) Oxides: XRay Photoelectron Spectrum and Ab-Initio Calculation of Band Structure
by: V. N. Uvarov, et al.
Published: (2013)

Elastic properties of 5d transition-metal carbides: An ab initio study
by: Mex, L., et al.
Published: (2015)

Formation of hydrogen bonds and vibrational processes in dimethyl sulfoxide and its aqueous solutions: Raman spectroscopy and ab initio calculations
by: A. Jumabaev, et al.
Published: (2023)

Formation of hydrogen bonds and vibrational processes in dimethyl sulfoxide and its aqueous solutions: Raman spectroscopy and ab initio calculations
by: A. Jumabaev, et al.
Published: (2023)

Electronic structure of 2H-SnSe2: ab initio modeling and comparison with experiment
by: D. I. Bletskan, et al.
Published: (2016)

Electronic Structure of Vanadium-Containing Apatite Similar Compounds of the Calcium Isomorphically Modified with Alkaline and Rare-Earth Metals
by: Kh. Kasijanenko, et al.
Published: (2015)

Synthesis and study of apatite-related iron- and carbonate-containing calcium phosphates
by: N. Y. Strutynska, et al.
Published: (2024)

Ab initio calculations of structural, electronic and vibrational properties of BaTiO3 and SrTiO3 perovskite crystals with oxygen vacancies
by: L. L. Rusevich, et al.
Published: (2020)

Исследование структуры и спектральных свойств молекулы НОBr методами ab initio
by: Хоменко, Е.М.
Published: (2011)

Ab initio расчеты квантовых эффектов в кристаллах инертных газов под давлением
by: Жихарев, И.В., et al.
Published: (2011)

Synthesis and antimicrobial properties of apatite-related Cu, Zn-doped calcium phosphate
by: I. I. Hryniuk, et al.
Published: (2021)

Phase composition and magnetic structure of FeCoZr–(PbSrNaBi)(ZrTi)O3 nanocomposites
by: V. L. Karbivskyi, et al.
Published: (2011)

Electronic structure, phonon spectra and electron–phonon interaction in ScB2
by: S. M. Sichkar, et al.
Published: (2013)

Crystal structures of apatite-like compounds obtained by DFT calculations
by: Ihor Sukhenko
Published: (2024)