Search

Categories

Physical Chemistry

(1)

Theoretical and Computational Chemistry

(2)

Content Types

Working Paper

(2)

Published Date

Last 3 years

(2)

Keywords

Quantum Embedding

Authors

2 results in Keywords: Quantum Embedding

Physical Chemistry

Local Excitations of a Charged Nitrogen Vacancy in Diamond with Multireference Density Matrix Embedding Theory

Soumi Haldar, Abhishek Mitra, Matthew R. Hermes, Laura Gagliardi

Version 1 posted 28 February 2023

345

Downloads

Theoretical and Computational Chemistry

Efficient multi-configurational quantum chemistry approach to single-ion magnets based on density matrix embedding theory

Yuhang Ai, Qiming Sun, Hong Jiang

Version 1 posted 21 September 2022

332

Downloads