Theoretical study of the vertical excited states of benzene, pyrimidine, and pyrazine by the symmetry adapted cluster - Configuration interaction method.
Yongjian LiJian WanXin XuPublished in: J. Comput. Chem. (2007)
Keyphrases
- experimental study
- high accuracy
- high precision
- pairwise
- detection method
- clustering method
- theoretical analysis
- preprocessing
- synthetic data
- cost function
- experimental evaluation
- neural network
- computational cost
- data clustering
- optimization algorithm
- data points
- dynamic programming
- prior knowledge
- computational complexity
- similarity measure
- genetic algorithm