Fingerprint region of the formic acid dimer: variational vibrational computations in curvilinear coordinates
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Curvilinear kinetic energy models are developed for variational nuclear motion computations including the inter- and the low-frequency intra-molecular degrees of freedom of the formic acid dimer. The coupling of the...
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2019 ◽
Vol 234
(6)
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pp. 1779-1791
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2019 ◽
Vol 38
(2)
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pp. 829-844
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2005 ◽
Vol 1
(2)
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pp. 135-142
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