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Articles by
Chris Wolverton
Anomalous Reversal of Stability in Mo-containing Oxides: A Difficult Case Exhibiting Sensitivity to DFT+U and Distortion
8 January 2025 by
Tzu-Chen Liu
and
others
Materials Science
,
Computational Physics
Accelerating High-Throughput Phonon Calculations via Machine Learning Universal Potentials
12 July 2024 by
Huiju Lee
and
others
Materials Science
CSPBench: a benchmark and critical evaluation of Crystal Structure Prediction
30 June 2024 by
Lai Wei
and
others
Materials Science
Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange
5 April 2024 by
Matthew Evans
and
others
Materials Science
Tuning chemical short-range order for stainless behavior at reduced chromium concentrations in multi-principal element alloys
29 February 2024 by
W. Blades
and
others
Materials Science
Thermal stabilities Landscape of A
_2
BB
^{\prime}
O
_6
compounds
29 February 2024 by
Yateng Wang
and
others
Materials Science
Oxygen Vacancy Formation Energy in Metal Oxides: High Throughput Computational Studies and Machine Learning Predictions
3 September 2023 by
Bianca Baldassarri
and
others
at
Northwestern University
Materials Science
Phase Stability of Lead Phosphate Apatite Pb
_{10-x}
Cu
_{x}
(PO
_{4}
)
_{6}
O, Pb
_{10-x}
Cu
_{x}
(PO
_{4}
)
_{6}
(OH)
_{2}
, and Pb
_{8}
Cu
_{2}
(PO
_{4}
)
_{6}
14 August 2023 by
Jiahong Shen
and
others
Materials Science
,
Superconductivity
A Unified Understanding of Minimum Lattice Thermal Conductivity
20 June 2023 by
Yi Xia
and
others
Materials Science
Accelerated Screening of Ternary Chalcogenides for High-Performance Optoelectronic Materials
4 May 2023 by
Chen Shen
and
others
Materials Science
The Phase Stability Network of all Inorganic Materials
5 November 2022 by
Vinay Hegde
and
others
Materials Science
Testing the r
^2
SCAN density functional for the thermodynamic stability of solids with and without a van der Waals correction
4 August 2022 by
Manish Kothakonda
and
others
Materials Science
,
Chemical Physics
Assessing the accuracy of compound formation energies with quantum Monte Carlo
21 June 2022 by
Eric Isaacs
and
others
Materials Science
,
Computational Physics
Identification of High-Dielectric Constant Compounds from Statistical Design
9 June 2022 by
Abhijith Gopakumar
and
others
Materials Science
Recent Advances and Applications of Deep Learning Methods in Materials Science
28 October 2021 by
Kamal Choudhary
and
others
Materials Science
,
Computational Physics
OPTIMADE, an API for exchanging materials data
25 August 2021 by
Casper Andersen
and
others
Materials Science
Exploring low lattice thermal conductivity materials using chemical bonding principles
11 July 2021 by
Jiangang He
and
others
Materials Science
NASA GeneLab RNA-Seq Consensus Pipeline: Standardized Processing of Short-Read RNA-Seq Data
27 March 2021 by
E. Overbey
and
others
Bioinformatics
Accelerated Discovery of a Large Family of Quaternary Chalcogenides with very Low Lattice Thermal Conductivity
19 December 2020 by
Koushik Pal
and
others
Materials Science
Microscopic mechanism of unusual lattice thermal transport in TlInTe
_2
7 December 2020 by
Koushik Pal
and
others
Materials Science
Accurate and scalable multi-element graph neural network force field and molecular dynamics with direct force architecture
28 July 2020 by
Cheol Woo Park
and
others
Computational Physics
Prediction of Li intercalation voltages in rechargeable battery cathode materials: effects of exchange-correlation functional, van der Waals interactions, and Hubbard
U
3 March 2020 by
Eric Isaacs
and
others
Materials Science
,
Strongly Correlated Electrons
Direct Visualization of Electric Field induced Structural Dynamics in Monolayer Transition Metal Dichalcogenides
11 February 2020 by
Akshay Murthy
and
others
Materials Science
Leveraging Electron-Phonon Interaction to Enhance Thermoelectric Power Factor in Graphene-Like Semimetals
3 October 2019 by
Yi Xia
and
others
Materials Science
Electronic Structure and Phase Stability of Yb-filled CoSb
_3
Skutterudite Thermoelectrics from First Principles
29 July 2019 by
Eric Isaacs
and
Chris Wolverton
Materials Science
Developing an improved Crystal Graph Convolutional Neural Network framework for accelerated materials discovery
12 June 2019 by
Cheol Woo Park
and
Chris Wolverton
Computational Physics
,
Materials Science
An Enormous Class of Double Half-Heusler Compounds with Low Thermal Conductivity
28 January 2019 by
Shashwat Anand
and
others
Materials Science
Ternary mixed-anion semiconductors with tunable band gaps from machine-learning and crystal structure prediction
6 December 2018 by
Maximilian Amsler
and
others
Materials Science
Remarkable thermoelectric performance in BaPdS
_2
via pudding-mold band structure and ultralow lattice thermal conductivity
19 October 2018 by
Eric Isaacs
and
Chris Wolverton
Materials Science
Network analysis of synthesizable materials discovery
5 September 2018 by
Muratahan Aykol
and
others
Materials Science
,
Computational Physics
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