Article ID Journal Published Year Pages File Type
5383749 Chemical Physics Letters 2011 5 Pages PDF
Abstract
► Extending the KSCED method to orbital-dependent functionals. ► Analyzing the merits of exact-exchange in frozen-density embedding calculations. ► Accurate embedding simulations beyond LDA/GGA. ► Improved accuracy for single-particle properties of embedded systems.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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