Published 2016 | Version v1
Book

Quantum-chemical modeling of nanoparticles and TiO crystals with vacancies

  • 1. IKhTT UrO RAN, Ekaterinburg (Russian Federation)

Description

no abstract available

Part of:
All-Russian Conference «Solid state chemistry and functional materials - 2016», XI Seminar «Thermodynamics and materials science». Sat 20th Mendeleev Congress on general and applied chemistry. Conference proceedings

Additional details

Additional titles

Original title (Russian)
Квантово-химическое моделирование наночастиц и кристаллов TiO с вакансиями

Publishing Information

Publisher
IKhTT UrO RAN
Imprint Place
Ekaterinburg (Russian Federation)
ISBN
978-5-7691-2444-0
Imprint Title
All-Russian Conference #Left-Pointing Double Angle Quotation Mark#Solid state chemistry and functional materials - 2016#Right-Pointing Double Angle Quotation Mark#, XI Seminar #Left-Pointing Double Angle Quotation Mark#Thermodynamics and materials science#Right-Pointing Double Angle Quotation Mark#. Sat 20th Mendeleev Congress on general and applied chemistry. Conference proceedings
Imprint Pagination
368 p.
Journal Page Range
p. 258-260

Conference

Title
All-Russian Conference ''Solid state chemistry and functional materials - 2016''; 11. Seminar on Thermodynamics and materials science
Original Conference Title
Vserossijskaya konferentsiya «Khimiya tverdogo tela i funktsional'nye materialy - 2016», XI seminar «Termodinamika i materialovedenie»
Dates
20-23 Sep 2016
Place
Ekaterinburg (Russian Federation)

INIS

Country of Publication
Russian Federation
Country of Input or Organization
Russian Federation
INIS RN
49081265
Subject category
S77: NANOSCIENCE AND NANOTECHNOLOGY;
Resource subtype / Literary indicator
No Abstract, Conference
Descriptors DEI
CRYSTALS; DENSITY FUNCTIONAL METHOD; FORMATION FREE ENERGY; NANOPARTICLES; TITANIUM OXIDES; VACANCIES
Descriptors DEC
CALCULATION METHODS; CHALCOGENIDES; CRYSTAL DEFECTS; CRYSTAL STRUCTURE; ENERGY; FREE ENERGY; OXIDES; OXYGEN COMPOUNDS; PARTICLES; PHYSICAL PROPERTIES; POINT DEFECTS; THERMODYNAMIC PROPERTIES; TITANIUM COMPOUNDS; TRANSITION ELEMENT COMPOUNDS; VARIATIONAL METHODS

Optional Information

Notes
1 ref., 2 figs. Imprint:Vserossijskaya konferentsiya #Left-Pointing Double Angle Quotation Mark#Khimiya tverdogo tela i funktsional'nye materialy - 2016#Right-Pointing Double Angle Quotation Mark#, XI seminar #Left-Pointing Double Angle Quotation Mark#Termodinamika i materialovedenie#Right-Pointing Double Angle Quotation Mark#. Satellit XX Mendeleevskogo s''ezda po obshchej i prikladnoj khimii. Sbornik trudov konferentsii