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Search Results - "Ab-initio CCSD(T) and CCSD(T)-F12 calculations"
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CCSD(T)-F12 calculations of the IR spectrum of cyanoacetylene HC3N beyond the harmonic approximation
by
Dargelos, Alain
,
Pouchan, Claude
Published in
Chemical physics letters
(01.09.2020)
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Journal Article
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chemistry
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Topic
ab-initio ccsd and ccsd-f
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ab-initio ccsd and ccsd-f12 calculations
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calculations
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chemical sciences
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cyanoacetylene molecule
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ir spectroscopy
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English
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Elsevier SD Freedom Collection
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Baden-Württemberg Complete Freedom Collection (Elsevier)
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