An ab initio calculation of the force fi
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P. Botschwina
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Article
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1974
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Elsevier Science
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English
β 490 KB
The &monk foice field of mgh&neimine (HzCNH) in the A' symmetry species has been calculated.from ab initiq SCF wavefunctions and is compared with the force Gel& of ethylene and formaldehyde. Vibrational frequenties and normal modes of vibrations have been calculated in o&er to give an explanationof