Cluster-MLP: An Active Learning Genetic Algorithm Framework for Accelerated Discovery of Global Minimum Configurations of Pure and Alloyed Nanoclusters.
Rajesh K. RajuSaurabh SivakumarXiaoxiao WangZachary W. UlissiPublished in: J. Chem. Inf. Model. (2023)
Keyphrases
- global minimum
- genetic algorithm
- active learning
- energy function
- neural network
- back propagation
- artificial neural networks
- cost function
- simulated annealing
- multilayer perceptron
- energy minimization
- semi supervised
- global minimization
- global optimum
- global optimization
- radial basis function
- probabilistic model
- search space
- objective function
- image processing
- machine learning