Performance of Bootstrap Embedding for long-range interactions and 2D systems

Fragment embedding approaches offer the possibility of accurate description of strongly correlated systems with low-scaling computational expense. In particular, wave function embedding approaches have demonstrated the ability to subdivide systems across highly entangled regions, promising wide appl...

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Bibliographic Details
Main Authors: Ricke, Nathan Darrell, Welborn, Matthew Gregory, Ye, Hongzhou, Van Voorhis, Troy
Other Authors: Massachusetts Institute of Technology. Department of Chemistry
Format: Article
Language:en_US
Published: Taylor & Francis 2018
Online Access:http://hdl.handle.net/1721.1/115095
https://orcid.org/0000-0002-5338-8876
https://orcid.org/0000-0001-8659-6535
https://orcid.org/0000-0002-3714-2753
https://orcid.org/0000-0001-7111-0176