|
Nanograined Half-Heusler Semiconductors as Advanced Thermoelectrics: An Ab Initio High-Throughput Statistical Study
|
journal
|
September 2014 |
|
Theorie des festen Zustandes einatomiger Elemente
|
journal
|
January 1912 |
|
Zur kinetischen Theorie der Wärmeleitung in Kristallen
|
journal
|
January 1929 |
|
Activation of Multiple CH Bonds Promoted by Gold in AuNbO 3 + Clusters
|
journal
|
January 2013 |
|
ChemInform Abstract: Crystal Structures of MSnF3 for M: K, Rb, Tl; Ionic Mobility.
|
journal
|
May 1993 |
|
Calculating the thermal conductivity of the silicon clathrates using the quasi-harmonic approximation: Quasi-harmonic thermal conductivity
|
journal
|
November 2015 |
|
Shell Model Calculation of Thermal Expansion of Alkali Halides and Magnesium Oxide
|
journal
|
July 1971 |
|
Structure and dynamics of perovskite-type crystals
|
journal
|
January 1968 |
|
�ber CsHgF3, RbHgF3 und KHgF3
|
journal
|
October 1969 |
|
Neue tern�re Fluoride mit einwertigem Thallium und Silber als Kationen
|
journal
|
March 1973 |
|
Preparation and properties of ferrimagnets in the RbMgF3-RbCoF3 system
|
journal
|
August 1969 |
|
The effect of pressure and B-cation size on the crystal structure of CsBF3 compounds (B=Mn, Fe, Co, Ni, Zn, Mg)
|
journal
|
June 1969 |
|
Some ABO3 oxides with defect pyrochlore structure
|
journal
|
August 1975 |
|
Structural phase transitions in KCdF3
|
journal
|
August 1977 |
|
Low energy phonon dispersion curves of KZnF3 and CsCaF3
|
journal
|
April 1981 |
|
A chemical scale for crystal-structure maps
|
journal
|
July 1984 |
|
Experimental and theoretical study of second-order Raman scattering in BaLiF3
|
journal
|
January 1994 |
|
Thermal diffusivity of BaLiF3 crystals
|
journal
|
July 1994 |
|
Heat capacities and thermal conductivities of perovskite type BaZrO3 and BaCeO3
|
journal
|
September 2003 |
|
AFLOW: An automatic framework for high-throughput materials discovery
|
journal
|
June 2012 |
|
A RESTful API for exchanging materials data in the AFLOWLIB.org consortium
|
journal
|
October 2014 |
|
The AFLOW standard for high-throughput materials science calculations
|
journal
|
October 2015 |
|
ShengBTE: A solver of the Boltzmann transport equation for phonons
|
journal
|
June 2014 |
|
Phase transition in CaSiO3 perovskite
|
journal
|
August 2007 |
|
Thermoelectric properties of reduced and La-doped single-crystalline SrTiO3
|
journal
|
April 2005 |
|
Thermal and mechanical properties of perovskite-type barium hafnate
|
journal
|
January 2006 |
|
Thermal and mechanical properties of polycrystalline BaSnO3
|
journal
|
June 2006 |
|
Thermophysical properties of SrHfO3 and SrRuO3
|
journal
|
October 2004 |
|
Synthesis and characterization of ASnF3 (A=Na+, K+, Rb+, Cs+)
|
journal
|
February 2014 |
|
Theoretical study of the structural, elastic, electronic and optical properties of XCaF3 (X = K and Rb)
|
journal
|
May 2015 |
|
The anion disorder in the perovskite fluoride KCaF3
|
journal
|
May 2005 |
|
Mechanochemical synthesis and order–disorder phase transition in fluoride ion conductor RbPbF3
|
journal
|
July 2008 |
|
Hydrothermal Dehydration of Precipitates: Convenient Synthesis Method for Solids
|
journal
|
April 2001 |
|
Preparation, Single Crystal Growth, and Crystallographic Properties of FeF 2 , RbFeF 3 , and CsFeF 3
|
journal
|
August 1966 |
|
The Nature of the Chemical Bond. iv. the Energy of Single Bonds and the Relative Electronegativity of Atoms
|
journal
|
September 1932 |
|
Pronounced Negative Thermal Expansion from a Simple Structure: Cubic ScF 3
|
journal
|
November 2010 |
|
Direct Cupration of Fluoroform
|
journal
|
December 2011 |
|
Lattice thermal conductivity of minerals at high temperatures
|
journal
|
February 1974 |
|
Resonant bonding leads to low lattice thermal conductivity
|
journal
|
April 2014 |
|
The high-throughput highway to computational materials design
|
journal
|
February 2013 |
|
Computational screening of perovskite metal oxides for optimal solar light capture
|
journal
|
January 2012 |
|
Glass-like thermal conductivity in SrTiO 3 thermoelectrics induced by A-site vacancies
|
journal
|
January 2014 |
|
Bulk electronic structure of SrTiO3: Experiment and theory
|
journal
|
December 2001 |
|
Thermal conductivity of perovskite ferroelectrics
|
journal
|
September 2008 |
|
Nanoscale thermal transport. II. 2003–2012
|
journal
|
March 2014 |
|
Lead difluoride and related systems
|
journal
|
April 2004 |
|
From the Molecular Picture to the Band Structure of Cubic and Tetragonal Barium Titanate
|
journal
|
June 2005 |
|
The 193 K phase transition in RbCaF3
|
journal
|
January 1976 |
|
Phase transitions in AgTaO 3 single crystals
|
journal
|
January 1981 |
|
On the phase transitions in silver niobate AgNbO 3
|
journal
|
January 1983 |
|
Phase transitions in AgTa x Nb 1−x O 3 solid solutions
|
journal
|
January 1987 |
|
Structural phase transitions in KCdF 3 and K 0.5 Rb 0.5 CdF 3
|
journal
|
January 1990 |
|
Calculation of the thermal conductivity of alkali halide crystals
|
journal
|
March 1987 |
|
An Investigation of the Cubic-Hexagonal Transition in Barium Titanate
|
journal
|
November 1960 |
|
Superionic phases in the (PbF 2 ) 1- x -(MF) x , M = K, Rb and Cs, systems
|
journal
|
January 1999 |
|
Powder neutron diffraction study of the high temperature phase transitions in NaTaO 3
|
journal
|
August 1999 |
|
Specific heat and heat conductivity of BaTiO 3 polycrystalline films in the thickness range 20–1100 nm
|
journal
|
June 2003 |
|
Structural investigation of AgNbO 3 phases using x-ray and neutron diffraction
|
journal
|
April 2004 |
|
An electron paramagnetic resonance study of Fe 3+ centres in Tl 2 MgF 4 and Tl 2 ZnF 4 crystals
|
journal
|
March 2006 |
|
On the Pb thermal vibrations in PbHfO 3 crystals
|
journal
|
June 1994 |
|
Thermal Conductivity of Silicon and Germanium from 3°K to the Melting Point
|
journal
|
May 1964 |
|
Dielectric Properties and Phase Transitions of NaNb O 3 and (Na,K)Nb O 3
|
journal
|
November 1954 |
|
Electronic band structure of the alkali halides. I. Experimental parameters
|
journal
|
June 1975 |
|
Crystallographic, elastic, and Raman scattering investigations of structural phase transitions in RbCd F 3 and TlCd F 3
|
journal
|
August 1975 |
|
Electronic structure of CuCl
|
journal
|
August 1979 |
|
Pressure and temperature effects on the thermal conductivity of CuCl
|
journal
|
August 1982 |
|
Raman-scattering investigation of the hexagonal perovskite RbZnF 3
|
journal
|
October 1995 |
|
High-temperature phase transitions in SrHfO 3
|
journal
|
August 1999 |
|
Lattice thermal conductivity of silicon from empirical interatomic potentials
|
journal
|
July 2005 |
|
Phase stability and structural temperature dependence in sodium niobate: A high-resolution powder neutron diffraction study
|
journal
|
April 2011 |
|
Screening for high-performance piezoelectrics using high-throughput density functional theory
|
journal
|
July 2011 |
|
Lattice dynamics of anharmonic solids from first principles
|
journal
|
November 2011 |
|
Temperature-dependent effective third-order interatomic force constants from first principles
|
journal
|
October 2013 |
|
Modeling the thermal conductivities of the zinc antimonides ZnSb and Zn 4 Sb 3
|
journal
|
January 2014 |
|
High-throughput screening of perovskite alloys for piezoelectric performance and thermodynamic stability
|
journal
|
April 2014 |
|
Self-consistent phonon calculations of lattice dynamical properties in cubic SrTiO 3 with first-principles anharmonic force constants
|
journal
|
August 2015 |
|
Anomalous thermal conductivity and suppression of negative thermal expansion in ScF 3
|
journal
|
July 2016 |
|
Entropy Driven Stabilization of Energetically Unstable Crystal Structures Explained from First Principles Theory
|
journal
|
March 2008 |
|
First-Principles Theory of Anharmonicity and the Inverse Isotope Effect in Superconducting Palladium-Hydride Compounds
|
journal
|
October 2013 |
|
Prediction of Low-Thermal-Conductivity Compounds with First-Principles Anharmonic Lattice-Dynamics Calculations and Bayesian Optimization
|
journal
|
November 2015 |
|
Structural Phase Transitions in Perovskite-Type Crystals
|
journal
|
October 1968 |
|
Thermal Expansion and Grüneisen Parameters of Amorphous Silicon: A Realistic Model Calculation
|
journal
|
September 1997 |
|
General Rules for Predicting Phase Transitions in Perovskites due to Octahedral Tilting
|
journal
|
July 2005 |
|
Finding Unprecedentedly Low-Thermal-Conductivity Half-Heusler Semiconductors via High-Throughput Materials Modeling
|
journal
|
February 2014 |
|
Thermal expansion and atomic displacement parameters of cubic KMgF 3 perovskite determined by high-resolution neutron powder diffraction
|
journal
|
May 2002 |
|
Structures and phase transitions in perovskites - a group-theoretical approach
|
journal
|
December 2004 |
|
Reactions between metal oxides and fluorides: some new double-fluoride structures of type AB F 3
|
journal
|
November 1952 |
|
Fluoride Model Systems: III, The System NaF-BeF2 and the Polymorphism of Na2BeF4 and BeF2
|
journal
|
June 1953 |
|
Crystal structures of SrSeO3 and CaSeO3 and their respective relationships with molybdomenite- and monazite-type compounds – an example for stereochemical equivalence of ESeO3 groups (E = lone electron pair) with tetrahedral TO4 groups
|
journal
|
August 2007 |
|
Ferroelectric properties of RbNbO3 and RbTaO3
|
journal
|
February 2015 |
|
The Crystal Structures of KMnF 3 , KFeF 3 , KCoF 3 , KNiF 3 and KCuF 3 above and below their Néel Temperatures
|
journal
|
April 1961 |
|
Thermal Conductivity of KMnF 3 , KCoF 3 , KNiF 3 , and KZnF 3 Single Crystals
|
journal
|
September 1964 |
|
The Anomalous Thermal Conduction in KFeF 3 Single Crystal at Low Temperatures
|
journal
|
November 1964 |
|
The unit cell and space-group of alamosite (PbSiO 3 )
|
journal
|
September 1952 |
|
Structure Evaluation of Bio-Compatible Lead-Free Piezoelectric Materials by Crystal System Distinction and First Principles Calculations [晶系判別および第一原理計算による生体適合無鉛圧電材料の構造評価]
|
journal
|
January 2006 |
|
Rhombohedral (9R) and hexagonal (6H) perovskites in barium silicates under high pressure
|
journal
|
April 2007 |
|
A new cubic perovskite in PbGeO3 at high pressures
|
journal
|
June 2012 |
|
Cubic perovskite polymorph of strontium metasilicate at high pressures
|
journal
|
November 2013 |