Hartree–Fock orbitals significantly improve the reaction barrier heights predicted by semilocal density functionals

标题
Hartree–Fock orbitals significantly improve the reaction barrier heights predicted by semilocal density functionals
作者
关键词
-
出版物
JOURNAL OF CHEMICAL PHYSICS
Volume 128, Issue 24, Pages 244112
出版商
AIP Publishing
发表日期
2008-06-28
DOI
10.1063/1.2940738

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