Identification of crystal symmetry from noisy diffraction patterns by a shape analysis and deep learning

Crystal symmetry determination in electron diffraction using machine learning

(2020) Kevin Kaufmann et al.   SCIENCE

Rapid Identification of X-ray Diffraction Patterns Based on Very Limited Data by Interpretable Convolutional Neural Networks

(2020) Hong Wang et al.   Journal of Chemical Information and Modeling

Self-driving laboratory for accelerated discovery of thin-film materials

(2020) B. P. MacLeod et al.   Science Advances

Using a machine learning approach to determine the space group of a structure from the atomic pair distribution function

(2019) Chia-Hao Liu et al.   Acta Crystallographica A-Foundation and Advances

Periocular Recognition in the Wild: Implementation of RGB-OCLBCP Dual-Stream CNN

(2019) Leslie Ching Ow Tiong et al.   Applied Sciences-Basel

Discovery of new materials using combinatorial synthesis and high-throughput characterization of thin-film materials libraries combined with computational methods

(2019) Alfred Ludwig   npj Computational Materials

A robotic platform for flow synthesis of organic compounds informed by AI planning

(2019) Connor W. Coley et al.   SCIENCE

Crystallographic prediction from diffraction and chemistry data for higher throughput classification using machine learning

(2019) Jeffery A. Aguiar et al.   COMPUTATIONAL MATERIALS SCIENCE

Decoding crystallography from high-resolution electron imaging and diffraction datasets with deep learning

(2019) J. A. Aguiar et al.   Science Advances

Crystal Structure Prediction via Deep Learning

(2018) Kevin Ryan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Classification of crystallization outcomes using deep convolutional neural networks

(2018) Andrew E. Bruno et al.   PLoS One

Developing the structure–property relationship to design solid state multi-stimuli responsive materials and their potential applications in different fields

(2018) Bibhisan Roy et al.   Chemical Science

Insightful classification of crystal structures using deep learning

(2018) Angelo Ziletti et al.   Nature Communications

DenseNet-Based Depth-Width Double Reinforced Deep Learning Neural Network for High-Resolution Remote Sensing Image Per-Pixel Classification

(2018) Yiting Tao et al.   Remote Sensing

Towards Generalized Noise-Level Dependent Crystallographic Symmetry Classifications of More or Less Periodic Crystal Patterns

(2018) Peter Moeck   Symmetry-Basel

AFLOW-SYM: platform for the complete, automatic and self-consistent symmetry analysis of crystals

(2018) David Hicks et al.   Acta Crystallographica A-Foundation and Advances

The Contribution of Synchrotron X-Ray Powder Diffraction to Modern Zeolite Applications: A Mini-review and Prospects

(2018) Benedict Tsz Woon Lo et al.   Chem

Understanding the physical metallurgy of the CoCrFeMnNi high-entropy alloy: an atomistic simulation study

(2018) Won-Mi Choi et al.   npj Computational Materials

Materials genomics methods for high-throughput construction of COFs and targeted synthesis

(2018) Youshi Lan et al.   Nature Communications

Classification of crystal structure using a convolutional neural network

(2017) Woon Bae Park et al.   IUCrJ

An indexing algorithm independent of peak position extraction for X-ray powder diffraction patterns

(2017) Alan A. Coelho   JOURNAL OF APPLIED CRYSTALLOGRAPHY

High-throughput synthesis and characterization of nanocrystalline porphyrinic zirconium metal–organic frameworks

(2016) M. L. Kelty et al.   CHEMICAL COMMUNICATIONS

Structure description, interpretation and classification in mineralogical crystallography

(2016) Sergey V. Krivovichev   Crystallography Reviews

Condor: a simulation tool for flash X-ray imaging

(2016) Max F. Hantke et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Big Data Analytics for Scanning Transmission Electron Microscopy Ptychography

(2016) S. Jesse et al.   Scientific Reports

High throughput synthesis and characterization of the PbnNb2O5+n (0.5

(2011) Mehdi Mirsaneh et al.   ACTA MATERIALIA

High-throughput electronic band structure calculations: Challenges and tools

(2010) Wahyu Setyawan et al.   COMPUTATIONAL MATERIALS SCIENCE

Magnetism in bcc and fcc Fe with carbon and manganese

(2010) N I Medvedeva et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

ExtSym: a program to aid space-group determination from powder diffraction data

(2008) Anders J. Markvardsen et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY