학술논문
Towards Efficient and Scalable Electronic Structure Methods for the Treatment of Relativistic Effects and Molecular Response.
Document Type
Theses
Author
Source
Dissertation Abstracts International; Dissertation Abstract International; 79-12B(E).
Subject
Language
English
Abstract
Summary: In the context of electronic structure theory, formal theoretical development must be accompanied by efficient and scalable computer implementation in order to study molecular systems at experimentally relevant scales. Thus, this work outlines s