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Reactivity indicators for degenerate states in the density-functional theoretic chemical reactivity theory

✍ Scribed by Cárdenas, Carlos; Ayers, Paul W.; Cedillo, Andrés


Book ID
120295090
Publisher
American Institute of Physics
Year
2011
Tongue
English
Weight
551 KB
Volume
134
Category
Article
ISSN
0021-9606

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