Element selection for functional materials discovery by integrated machine learning of atomic contributions to properties.
Andrij VasylenkoDmytro AntypovVladimir V. GusevMichael W. GaultoisMatthew S. DyerMatthew J. RosseinskyPublished in: CoRR (2022)
Keyphrases
- machine learning
- knowledge discovery
- data mining
- decision trees
- machine learning algorithms
- machine learning methods
- structural properties
- computer science
- data analysis
- knowledge representation
- desirable properties
- selection algorithm
- computer vision
- pattern discovery
- neural network
- machine learning approaches
- learning tasks
- real time
- scientific discovery
- text classification
- natural language processing
- supervised learning
- pattern recognition
- learning environment
- social networks
- learning algorithm
- genetic algorithm
- data sets