#Frank Neese


Exploring the accuracy of a low scaling similarity transformed equation of motion method for vertical excitation energies

Electronic Structure Theory Group IIT Bombay , Indian Institute of Technology Bombay

Accelerating the coupled-cluster singles and doubles method using the chain-of-sphere approximation

Electronic Structure Theory Group IIT Bombay , Indian Institute of Technology Bombay

A simple scheme for calculating approximate transition moments within the equation of motion expectation value formalism

Electronic Structure Theory Group IIT Bombay , Indian Institute of Technology Bombay

Automatic active space selection for the similarity transformed equations of motion coupled cluster method

Electronic Structure Theory Group IIT Bombay , Indian Institute of Technology Bombay

Towards a pair natural orbital coupled cluster method for excited states

Electronic Structure Theory Group IIT Bombay , Indian Institute of Technology Bombay

Speeding up equation of motion coupled cluster theory with the chain of spheres approximation

Electronic Structure Theory Group IIT Bombay , Indian Institute of Technology Bombay