Application of Machine Learning to Predict Grain Boundary Embrittlement in Metals by Combining Bonding-Breaking and Atomic Size Effects

Prediction and analysis of high velocity oxy fuel (HVOF) sprayed coating using artificial neural network

(2019) Meimei Liu et al.   SURFACE & COATINGS TECHNOLOGY

Partitioning of Interstitial Segregants during Decohesion: A DFT Case Study of the Σ3 Symmetric Tilt Grain Boundary in Ferritic Steel

(2019) Xiang Huang et al.   Materials

Machine learning models for the lattice thermal conductivity prediction of inorganic materials

(2019) Lihua Chen et al.   COMPUTATIONAL MATERIALS SCIENCE

Predicting phase behavior of grain boundaries with evolutionary search and machine learning

(2018) Qiang Zhu et al.   Nature Communications

Parameter Matching and Instantaneous Power Allocation for the Hybrid Energy Storage System of Pure Electric Vehicles

(2018) Xingyue Jiang et al.   Energies

Study on the factors affecting solid solubility in binary alloys: An exploration by Machine Learning

(2018) Shengzhou Li et al.   JOURNAL OF ALLOYS AND COMPOUNDS

Fast and scalable prediction of local energy at grain boundaries: machine-learning based modeling of first-principles calculations

(2017) Tomoyuki Tamura et al.   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING

Interfacial segregation and grain boundary embrittlement: An overview and critical assessment of experimental data and calculated results

(2017) Pavel Lejček et al.   PROGRESS IN MATERIALS SCIENCE

Computational study of metallic dopant segregation and embrittlement at molybdenum grain boundaries

(2016) Richard Tran et al.   ACTA MATERIALIA

First-principles determination of grain boundary strengthening in tungsten: Dependence on grain boundary structure and metallic radius of solute

(2016) Xuebang Wu et al.   ACTA MATERIALIA

A survey of ab-initio calculations shows that segregation-induced grain boundary embrittlement is predicted by bond-breaking arguments

(2016) Michael A. Gibson et al.   SCRIPTA MATERIALIA

A first principles investigation of zinc induced embrittlement at grain boundaries in bcc iron

(2015) Klaus-Dieter Bauer et al.   ACTA MATERIALIA

First-principles-aided design of a new Ni-base superalloy: Influence of transition metal alloying elements on grain boundary and bulk cohesion

(2015) V.I. Razumovskiy et al.   ACTA MATERIALIA

Segregation-induced changes in grain boundary cohesion and embrittlement in binary alloys

(2015) Michael A. Gibson et al.   ACTA MATERIALIA

An analysis of segregation-induced changes in grain boundary cohesion in bcc iron

(2013) Pavel Lejček et al.   JOURNAL OF MATERIALS SCIENCE

Ab initiocalculation of traction separation laws for a grain boundary in molybdenum with segregated C impurites

(2013) A M Tahir et al.   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING

Origin of the Bismuth-Induced Decohesion of Nickel and Copper Grain Boundaries

(2013) Joongoo Kang et al.   PHYSICAL REVIEW LETTERS

LIBSVM

(2012) Chih-Chung Chang et al.   ACM Transactions on Intelligent Systems and Technology

First principles investigation of zinc-induced embrittlement in an aluminum grain boundary

(2011) Shengjun Zhang et al.   ACTA MATERIALIA

The effect of segregated sp-impurities on grain-boundary and surface structure, magnetism and embrittlement in nickel

(2011) M. Všianská et al.   PROGRESS IN MATERIALS SCIENCE

First-Principles Study on the Grain Boundary Embrittlement of Metals by Solute Segregation: Part I. Iron (Fe)-Solute (B, C, P, and S) Systems

(2010) Masatake Yamaguchi   METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE

Cohesive and magnetic properties of grain boundaries in bcc Fe with Cr additions

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

Sodium-induced embrittlement of an aluminum grain boundary

(2010) Shengjun Zhang et al.   PHYSICAL REVIEW B

Observations of Intergranular Stress Corrosion Cracking in a Grain-Mapped Polycrystal

(2008) A. King et al.   SCIENCE