Estimation of matrix trace using machine learning

Abstract: We present a new trace estimator of the matrix whose explicit form is not given but its matrix multiplication to a vector is available. The form of the estimator is similar to the Hutchison stochastic trace estimator, but instead of the random noise vectors in Hutchison estimator, we use small number of probing vectors determined by machine learning. Evaluation of the quality of estimates and bias correction are discussed. An unbiased estimator is proposed for the calculation of the expectation value of a function of traces. In the numerical experiments with random matrices, it is shown that the precision of trace estimates with $\mathcal{O}(10)$ probing vectors determined by the machine learning is similar to that with $\mathcal{O}(10000)$ random noise vectors.