Related references
Note: Only part of the references are listed.A Latent Variable Approach to Gaussian Process Modeling with Qualitative and Quantitative Factors
Yichi Zhang et al.
TECHNOMETRICS (2020)
Bayesian Optimization for Materials Design with Mixed Quantitative and Qualitative Variables
Yichi Zhang et al.
SCIENTIFIC REPORTS (2020)
Active learning in materials science with emphasis on adaptive sampling using uncertainties for targeted design
Turab Lookman et al.
NPJ COMPUTATIONAL MATERIALS (2019)
Towards Oxide Electronics: a Roadmap
M. Coll et al.
APPLIED SURFACE SCIENCE (2019)
Recent advances and applications of machine learning in solid-state materials science
Jonathan Schmidt et al.
NPJ COMPUTATIONAL MATERIALS (2019)
Inverse Design of Solid-State Materials via a Continuous Representation
Juhwan Noh et al.
MATTER (2019)
Assessing exchange-correlation functional performance in the chalcogenide lacunar spinels GaM4Q8 (M = Mo, V, Nb, Ta; Q = S,Se)
Yiqun Wang et al.
PHYSICAL REVIEW B (2019)
Machine learning of phase transitions in the percolation and XY models
Wanzhou Zhang et al.
PHYSICAL REVIEW E (2019)
BoltzTraP2, a program for interpolating band structures and calculating semi-classical transport coefficients
Georg K. H. Madsen et al.
COMPUTER PHYSICS COMMUNICATIONS (2018)
Crystal Graph Convolutional Neural Networks for an Accurate and Interpretable Prediction of Material Properties
Tian Xie et al.
PHYSICAL REVIEW LETTERS (2018)
Multi-objective Optimization for Materials Discovery via Adaptive Design
Abhijith M. Gopakumar et al.
SCIENTIFIC REPORTS (2018)
Thermodynamic limit for synthesis of metastable inorganic materials
Muratahan Aykol et al.
SCIENCE ADVANCES (2018)
Inverse design in search of materials with target functionalities
Alex Zunger
NATURE REVIEWS CHEMISTRY (2018)
Machine learning for molecular and materials science
Keith T. Butler et al.
NATURE (2018)
Physical descriptor for the Gibbs energy of inorganic crystalline solids and temperature-dependent materials chemistry
Christopher J. Bartel et al.
NATURE COMMUNICATIONS (2018)
Ultrafast Structure Switching through Nonlinear Phononics
D. M. Juraschek et al.
PHYSICAL REVIEW LETTERS (2017)
High-Dimensional Materials and Process Optimization Using Data-Driven Experimental Design with Well-Calibrated Uncertainty Estimates
Julia Ling et al.
INTEGRATING MATERIALS AND MANUFACTURING INNOVATION (2017)
Covalent bonds against magnetism in transition metal compounds
Sergey V. Streltsov et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2016)
Perspective: Materials informatics and big data: Realization of the fourth paradigm of science in materials science
Ankit Agrawal et al.
APL MATERIALS (2016)
Neel-type skyrmion lattice with confined orientation in the polar magnetic semiconductor GaV4S8
I. Kezsmarki et al.
NATURE MATERIALS (2015)
Polar Dynamics at the Jahn-Teller Transition in Ferroelectric GaV4S8
Zhe Wang et al.
PHYSICAL REVIEW LETTERS (2015)
Prediction of Low-Thermal-Conductivity Compounds with First-Principles Anharmonic Lattice-Dynamics Calculations and Bayesian Optimization
Atsuto Seko et al.
PHYSICAL REVIEW LETTERS (2015)
Mott Memory and Neuromorphic Devices
You Zhou et al.
PROCEEDINGS OF THE IEEE (2015)
First principles phonon calculations in materials science
Atsushi Togo et al.
SCRIPTA MATERIALIA (2015)
A steep-slope transistor based on abrupt electronic phase transition
Nikhil Shukla et al.
NATURE COMMUNICATIONS (2015)
The Open Quantum Materials Database (OQMD): assessing the accuracy of DFT formation energies
Scott Kirklin et al.
npj Computational Materials (2015)
First-Order Insulator-to-Metal Mott Transition in the Paramagnetic 3D System GaTa4Se8
A. Camjayi et al.
PHYSICAL REVIEW LETTERS (2014)
Spin-orbital entangled molecular jeff states in lacunar spinel compounds
Heung-Sik Kim et al.
NATURE COMMUNICATIONS (2014)
Electric field induced avalanche breakdown and non-volatile resistive switching in the Mott Insulators AM4Q8
B. Corraze et al.
EUROPEAN PHYSICAL JOURNAL-SPECIAL TOPICS (2013)
High-Throughput Computational Screening of New Li-Ion Battery Anode Materials
Scott Kirklin et al.
ADVANCED ENERGY MATERIALS (2013)
Oxide Electronics Utilizing Ultrafast Metal-Insulator Transitions
Zheng Yang et al.
ANNUAL REVIEW OF MATERIALS RESEARCH, VOL 41 (2011)
Electric-Field-Induced Resistive Switching in a Family of Mott Insulators: Towards a New Class of RRAM Memories
Laurent Cario et al.
ADVANCED MATERIALS (2010)
Half-Metallic Ferromagnetism and Large Negative Magnetoresistance in the New Lacunar Spinel GaTi3VS8
Eugen Dorolti et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)
Electric-pulse-driven electronic phase separation, insulator-metal transition, and possible superconductivity in a Mott insulator
Cristian Vaju et al.
ADVANCED MATERIALS (2008)
Importance of cluster distortions in the tetrahedral cluster compounds GaM4X8 (M=Mo,V,Nb,Ta; X=S,Se):: Ab initio investigations
M. Sieberer et al.
PHYSICAL REVIEW B (2007)
Cation substitution in defect thiospinels:: Structural and magnetic properties of GaV4-xMOxS8 (0≤ x≤4)
Anthony V. Powell et al.
CHEMISTRY OF MATERIALS (2007)
Tuning of metal-metal bonding and magnetism via the electron count in GaxV4-yCryS8
Daniel Bichler et al.
CHEMISTRY OF MATERIALS (2007)
Electronic and structural instabilities in GaV4S8 and GaMo4S8
R Pocha et al.
CHEMISTRY OF MATERIALS (2000)