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Generalized-active-space pair-density functional theory: an efficient method to study large, strongly correlated, conjugated systems
Ghosh, Soumen, Cramer, Christopher J., Truhlar, Donald G., Gagliardi, LauraVolume:
8
Year:
2017
Language:
english
Journal:
Chem. Sci.
DOI:
10.1039/c6sc05036k
File:
PDF, 1.53 MB
english, 2017