4.6 Article

Novel IV-V-VI semiconductors with ultralow lattice thermal conductivity

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。
Article Materials Science, Multidisciplinary

ALKEMIE: An intelligent computational platform for accelerating materials discovery and design

Guanjie Wang et al.

Summary: The traditional trial-and-error ways of developing new materials are cost-inefficient, leading to the rise of simulation-driven materials design in the past decades. However, the era of data-driven material science calls for an intelligent computational platform to accelerate the discovery and design for advanced materials. ALKEMIE, an open source computational platform, plays a crucial role in providing easy access to data-driven techniques for a wide range of communities, incorporating key components such as data generation, management, and mining via machine learning models.

COMPUTATIONAL MATERIALS SCIENCE (2021)

Article Multidisciplinary Sciences

U1 snRNP regulates cancer cell migration and invasion in vitro

Jung-Min Oh et al.

NATURE COMMUNICATIONS (2020)

Article Chemistry, Multidisciplinary

Diffused Lattice Vibration and Ultralow Thermal Conductivity in the Binary Ln-Nb-O Oxide System

Jun Yang et al.

ADVANCED MATERIALS (2019)

Review Nanoscience & Nanotechnology

Designing crystallization in phase-change materials for universal memory and neuro-inspired computing

Wei Zhang et al.

NATURE REVIEWS MATERIALS (2019)

Article Multidisciplinary Sciences

Two-channel model for ultralow thermal conductivity of crystalline Tl3VSe4

Saikat Mukhopadhyay et al.

SCIENCE (2018)

Article Chemistry, Multidisciplinary

Intrinsic Rattler-Induced Low Thermal Conductivity in Zintl Type TlInTe2

Manoj K. Jana et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2017)

Article Chemistry, Multidisciplinary

High Thermoelectric Performance in Electron-Doped AgBi3S5 with Ultralow Thermal Conductivity

Gangjian Tan et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2017)

Article Chemistry, Multidisciplinary

LOBSTER: A Tool to Extract Chemical Bonding from Plane-Wave Based DFT

Stefan Maintz et al.

JOURNAL OF COMPUTATIONAL CHEMISTRY (2016)

Article Physics, Multidisciplinary

Ultralow Thermal Conductivity in Full Heusler Semiconductors

Jiangang He et al.

PHYSICAL REVIEW LETTERS (2016)

Review Materials Science, Multidisciplinary

Strategies for engineering phonon transport in thermoelectrics

Woochul Kim

JOURNAL OF MATERIALS CHEMISTRY C (2015)

Article Computer Science, Interdisciplinary Applications

ShengBTE: A solver of the Boltzmann transport equation for phonons

Wu Li et al.

COMPUTER PHYSICS COMMUNICATIONS (2014)

Article Chemistry, Multidisciplinary

Lone pair electrons minimize lattice thermal conductivity

Michele D. Nielsen et al.

ENERGY & ENVIRONMENTAL SCIENCE (2013)

Review Chemistry, Multidisciplinary

Resonant levels in bulk thermoelectric semiconductors

Joseph P. Heremans et al.

ENERGY & ENVIRONMENTAL SCIENCE (2012)

Article Multidisciplinary Sciences

High-performance bulk thermoelectrics with all-scale hierarchical architectures

Kanishka Biswas et al.

NATURE (2012)

Article Materials Science, Multidisciplinary

Thermal conductivity of bulk and nanowire Mg2SixSn1-x alloys from first principles

Wu Li et al.

PHYSICAL REVIEW B (2012)

Article Multidisciplinary Sciences

Convergence of electronic bands for high performance bulk thermoelectrics

Yanzhong Pei et al.

NATURE (2011)

Article Chemistry, Physical

Disorder-induced localization in crystalline phase-change materials

T. Siegrist et al.

NATURE MATERIALS (2011)

Review Chemistry, Multidisciplinary

Phase Change Materials and Their Application to Nonvolatile Memories

Simone Raoux et al.

CHEMICAL REVIEWS (2010)

Article Chemistry, Physical

Li-Fe-P-O2 phase diagram from first principles calculations

Shyue Ping Ong et al.

CHEMISTRY OF MATERIALS (2008)

Article Chemistry, Inorganic & Nuclear

Covalent radii revisited

Beatriz Cordero et al.

DALTON TRANSACTIONS (2008)

Review Chemistry, Multidisciplinary

Ab-initio simulations of materials using VASP: Density-functional theory and beyond

Juergen Hafner

JOURNAL OF COMPUTATIONAL CHEMISTRY (2008)

Article Physics, Multidisciplinary

Ultralow thermal conductivity in highly anion-defective aluminates

Chunlei Wan et al.

PHYSICAL REVIEW LETTERS (2008)

Article Chemistry, Multidisciplinary

Semiempirical GGA-type density functional constructed with a long-range dispersion correction

Stefan Grimme

JOURNAL OF COMPUTATIONAL CHEMISTRY (2006)

Article Materials Science, Multidisciplinary

Lattice thermal conductivity of silicon from empirical interatomic potentials

DA Broido et al.

PHYSICAL REVIEW B (2005)

Review Multidisciplinary Sciences

Materials science - Thermal barrier coatings for gas-turbine engine applications

NP Padture et al.

SCIENCE (2002)

Article Materials Science, Multidisciplinary

Thermoelectric properties of nGeTe•mSb2Te3 layered compounds

PP Konstantinov et al.

INORGANIC MATERIALS (2001)

Review Physics, Multidisciplinary

Phonons and related crystal properties from density-functional perturbation theory

S Baroni et al.

REVIEWS OF MODERN PHYSICS (2001)

Article Chemistry, Multidisciplinary

Thermoelectric properties and crystal structure of ternary compounds in the Ge(Sn,Pb)Te-Bi2Te3 systems

LA Kuznetsova et al.

JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS (2000)