相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Characterization of the high-pressure structures and phase transformations in SnO2.: A density functional theory study
L. Gracia et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2007)
Growth of one-dimensional Pd nanowires on the terraces of a reduced SnO2(101) surface
Khabibulakh Katsiev et al.
PHYSICAL REVIEW LETTERS (2007)
Ab initio FP-LAPW study of the semiconductors SnO and SnO2
Leonardo A. Errico
PHYSICA B-CONDENSED MATTER (2007)
Density functional theory with dispersion corrections for supramolecular structures, aggregates, and complexes of (bio)organic molecules
Stefan Grimme et al.
ORGANIC & BIOMOLECULAR CHEMISTRY (2007)
Surface science studies of gas sensing materials:: SnO2
Matthias Batzill
SENSORS (2006)
Tuning surface properties of SnO2(101) by reduction
Matthias Batzill et al.
JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS (2006)
Room temperature gas sensitivity of ultrathin SnO2 films prepared from Langmuir-Blodgett film precursors
Sipra Choudhury et al.
APPLIED PHYSICS LETTERS (2006)
Plain DFT and hybrid HF-DFT LCAO calculations of SnO2 (110) and (100) bare and hydroxylated surfaces
R. A. Evarestov et al.
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS (2006)
Linear optical properties of solids within the full-potential linearized augmented planewave method
Claudia Ambrosch-Draxl et al.
COMPUTER PHYSICS COMMUNICATIONS (2006)
Optical band-edge absorption of oxide compound SnO2
LS Roman et al.
APPLIED SURFACE SCIENCE (2006)
Metal oxide nano-crystals for gas sensing
Elisabetta Comini
ANALYTICA CHIMICA ACTA (2006)
Derivation of force field parameters for SnO2-H2O surface systems from plane-wave density functional theory calculations
AV Bandura et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
Characterizing solid state gas responses using surface charging in photoemission:: water adsorption on SnO2(101)
M Batzill et al.
JOURNAL OF PHYSICS-CONDENSED MATTER (2006)
Humidity sensors: A review of materials and mechanisms
Z Chen et al.
SENSOR LETTERS (2005)
Gas-phase-dependent properties of SnO2 (110), (100), and (101) single-crystal surfaces:: Structure, composition, and electronic properties -: art. no. 165414
M Batzill et al.
PHYSICAL REVIEW B (2005)
Electronic and structural properties of SnO under pressure -: art. no. 014109
NE Christensen et al.
PHYSICAL REVIEW B (2005)
Van der Waals density functional theory with applications
DC Langreth et al.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2005)
First-principles calculations on the surface electronic and reactive properties of M/SnO2 (M = Ge, Mn) (110)
Y Yamaguchi et al.
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM (2005)
Reduced SnO2 surfaces by first-principles calculations
W Bergermayer et al.
APPLIED PHYSICS LETTERS (2004)
Dispersion corrections to density functionals for water aromatic interactions
U Zimmerli et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Accurate description of van der Waals complexes by density functional theory including empirical corrections
S Grimme
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Electronic structures of rocksalt, litharge, and herzenbergite SnO by density functional theory
A Walsh et al.
PHYSICAL REVIEW B (2004)
Van der Waals density functional for general geometries -: art. no. 246401
M Dion et al.
PHYSICAL REVIEW LETTERS (2004)
Semiempirical approach to the energetics of interlayer binding in graphite
M Hasegawa et al.
PHYSICAL REVIEW B (2004)
Thermodynamic argument about SnO2 nanoribbon growth
A Beltrán et al.
APPLIED PHYSICS LETTERS (2003)
Surface morphologies of SnO2(110)
M Batzill et al.
SURFACE SCIENCE (2003)
Density functional theory calculations for the interaction of oxygen with reduced M/SnO2(110) (M = Pd, Pt) surfaces
Y Yamaguchi et al.
SURFACE SCIENCE (2003)
Reconstructions of strongly reduced SnO2(110) studied by first-principles methods
J Oviedo et al.
SURFACE SCIENCE (2002)
Composition, structure, and stability of RuO2(110) as a function of oxygen pressure -: art. no. 035406
K Reuter et al.
PHYSICAL REVIEW B (2002)
Empirical correction to density functional theory for van der Waals interactions
Q Wu et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Electronic band structure of indium tin oxide and criteria for transparent conducting behavior
ON Mryasov et al.
PHYSICAL REVIEW B (2001)
Resistivity of polycrystalline zinc oxide films: current status and physical limit
K Ellmer
JOURNAL OF PHYSICS D-APPLIED PHYSICS (2001)
First-principles study of the interaction of oxygen with the SnO2(110) surface
J Oviedo et al.
SURFACE SCIENCE (2001)
Band structure and optical parameters of the SnO2(110) surface -: art. no. 075407
MA Mäki-Jaskari et al.
PHYSICAL REVIEW B (2001)
Ab initio pseudopotential calculation of the equilibrium structure of tin monoxide -: art. no. 045119
M Meyer et al.
PHYSICAL REVIEW B (2001)
Hydrogen bonding and stacking interactions of nucleic acid base pairs: A density-functional-theory based treatment
M Elstner et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
The SnO2(110)(4 x 1) structure determined by LEED intensity analysis
A Atrei et al.
SURFACE SCIENCE (2001)
The origin of the electron distribution in SnO
GW Watson
JOURNAL OF CHEMICAL PHYSICS (2001)
Theoretical study of the MoS2 (100) surface:: A chemical potential analysis of sulfur and hydrogen coverage
S Cristol et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2000)
The energetics and structure of oxygen vacancies on the SnO2(110) surface
J Oviedo et al.
SURFACE SCIENCE (2000)
Energetics and structure of stoichiometric SnO(2) surfaces studied by first-principles calculations
J Oviedo et al.
SURFACE SCIENCE (2000)