Sparse Correction in Coupled Cluster Calculations
发布时间：2015年11月18日
浏览次数：9899
发布者:
主讲人： Prof. Chao Yang, Lawrence Berkeley National Laboratory
活动时间： 从 2015-11-18 00:00 到 00:00
场地： Quan 9
主题: Sparse Correction in Coupled Cluster Calculations
报告人: Prof. Chao Yang, Lawrence Berkeley National Laboratory
时间： 2015-11-18 19:00-20:00
地点：北京国际数学研究中心全9教室
The coupled-cluster method is a highly accurate wavefunction method solving
a many-body Schrodinger's equation. However, its computational complexty
scales as O(N^6), where N is the number of electrons. In this talk, we
discuss a technique for reducing the cost of coupled-cluster calculation
by exploiting the sparsity of the correction tensor in an inexact Newton
method for solving the coupled-cluster nonlinear equation.
报告人: Prof. Chao Yang, Lawrence Berkeley National Laboratory
时间： 2015-11-18 19:00-20:00
地点：北京国际数学研究中心全9教室
The coupled-cluster method is a highly accurate wavefunction method solving
a many-body Schrodinger's equation. However, its computational complexty
scales as O(N^6), where N is the number of electrons. In this talk, we
discuss a technique for reducing the cost of coupled-cluster calculation
by exploiting the sparsity of the correction tensor in an inexact Newton
method for solving the coupled-cluster nonlinear equation.
