Data-driven design of B20 alloys with targeted magnetic properties guided by machine learning and density functional theory

Active learning in materials science with emphasis on adaptive sampling using uncertainties for targeted design

(2019) Turab Lookman et al.   npj Computational Materials

Machine learning guided design of single-molecule magnets for magnetocaloric applications

(2019) Ludwig Holleis et al.   APPLIED PHYSICS LETTERS

Electronic Structure of B20 (FeSi-Type) Transition-Metal Monosilicides

(2019) Dmitry A. Pshenay-Severin et al.   Materials

Predicting the Curie temperature of ferromagnets using machine learning

(2019) James Nelson et al.   Physical Review Materials

Compositional optimization of hard-magnetic phases with machine-learning models

(2018) Johannes J. Möller et al.   ACTA MATERIALIA

Chemical Pressure Stabilization of the Cubic B20 Structure in Skyrmion Hosting Fe1–xCoxGe Alloys

(2018) Matthew J. Stolt et al.   CHEMISTRY OF MATERIALS

First-Principles Evaluation of the Dzyaloshinskii–Moriya Interaction

(2018) Takashi Koretsune et al.   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

Fast current-driven domain walls and small skyrmions in a compensated ferrimagnet

(2018) Lucas Caretta et al.   Nature Nanotechnology

Correcting Systematic Underprediction of Biochemical Oxygen Demand in Support Vector Regression

(2017) Marvin X. C. Seow et al.   JOURNAL OF ENVIRONMENTAL ENGINEERING

Magnetic skyrmions on a two-lane racetrack

(2017) Jan Müller   NEW JOURNAL OF PHYSICS

Correcting Systematic Underprediction of Biochemical Oxygen Demand in Support Vector Regression

(2017) Marvin X. C. Seow et al.   JOURNAL OF ENVIRONMENTAL ENGINEERING

Predicting displacements of octahedral cations in ferroelectric perovskites using machine learning

(2017) Prasanna V. Balachandran et al.   Acta Crystallographica Section B-Structural Science Crystal Engineering and Materials

Accelerated discovery of new magnets in the Heusler alloy family

(2017) Stefano Sanvito et al.   Science Advances

Thermal stability and topological protection of skyrmions in nanotracks

(2017) David Cortés-Ortuño et al.   Scientific Reports

Variation of spin–orbit coupling and related properties in skyrmionic system Mn${}_{1\mbox{--}x}$FexGe

(2016) N Kanazawa et al.   NEW JOURNAL OF PHYSICS

Accelerated search for BaTiO3-based piezoelectrics with vertical morphotropic phase boundary using Bayesian learning

(2016) Dezhen Xue et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Accelerated search for materials with targeted properties by adaptive design

(2016) Dezhen Xue et al.   Nature Communications

Critical phenomenon of the near room temperature skyrmion material FeGe

(2016) Lei Zhang et al.   Scientific Reports

Dzyaloshinskii-Moriya Interaction and Hall Effects in the Skyrmion Phase ofMn1−xFexGe

(2015) J. Gayles et al.   PHYSICAL REVIEW LETTERS

Systematic Artifacts in Support Vector Regression-Based Compound Potency Prediction Revealed by Statistical and Activity Landscape Analysis

(2015) Jenny Balfer et al.   PLoS One

Materials Prediction via Classification Learning

(2015) Prasanna V. Balachandran et al.   Scientific Reports

Control of Dzyaloshinskii-Moriya interaction in Mn1−xFe x Ge: a first-principles study

(2015) Takashi Koretsune et al.   Scientific Reports

Pseudopotentials periodic table: From H to Pu

(2014) Andrea Dal Corso   COMPUTATIONAL MATERIALS SCIENCE

Data mining for materials design: A computational study of single molecule magnet

(2014) Hieu Chi Dam et al.   JOURNAL OF CHEMICAL PHYSICS

Theoretical model for Rashba spin-orbit interaction indelectrons

(2014) K. V. Shanavas et al.   PHYSICAL REVIEW B

Topological properties and dynamics of magnetic skyrmions

(2013) Naoto Nagaosa et al.   Nature Nanotechnology

Skyrmions on the track

(2013) Albert Fert et al.   Nature Nanotechnology

Data mining for materials: Computational experiments withABcompounds

(2012) Yousef Saad et al.   PHYSICAL REVIEW B

Structure and magnetic properties of MnSi epitaxial thin films

(2010) E. Karhu et al.   PHYSICAL REVIEW B

Spin Transfer Torques in MnSi at Ultralow Current Densities

(2010) F. Jonietz et al.   SCIENCE

Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces

(2008) John P. Perdew et al.   PHYSICAL REVIEW LETTERS