Items where Author is "Ryall, John"
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DFT calculations
Chowdhry, Babur, Dines, Trevor, Mendham, Andrew and Ryall, John (2015) Infrared and raman spectroscopy of eugenol, isoeugenol, and methyl eugenol: Conformational analysis and vibrational assignments from density functional theory calculations of the anharmonic fundamentals. The Journal of Physical Chemistry A, 119 (46). pp. 11280-11292. ISSN 1089-5639 (Print), 1520-5215 (Online) (doi:https://doi.org/10.1021/acs.jpca.5b07607)
eugenol
Chowdhry, Babur, Dines, Trevor, Mendham, Andrew and Ryall, John (2015) Infrared and raman spectroscopy of eugenol, isoeugenol, and methyl eugenol: Conformational analysis and vibrational assignments from density functional theory calculations of the anharmonic fundamentals. The Journal of Physical Chemistry A, 119 (46). pp. 11280-11292. ISSN 1089-5639 (Print), 1520-5215 (Online) (doi:https://doi.org/10.1021/acs.jpca.5b07607)
isoeugenol
Chowdhry, Babur, Dines, Trevor, Mendham, Andrew and Ryall, John (2015) Infrared and raman spectroscopy of eugenol, isoeugenol, and methyl eugenol: Conformational analysis and vibrational assignments from density functional theory calculations of the anharmonic fundamentals. The Journal of Physical Chemistry A, 119 (46). pp. 11280-11292. ISSN 1089-5639 (Print), 1520-5215 (Online) (doi:https://doi.org/10.1021/acs.jpca.5b07607)
methyl eugenol
Chowdhry, Babur, Dines, Trevor, Mendham, Andrew and Ryall, John (2015) Infrared and raman spectroscopy of eugenol, isoeugenol, and methyl eugenol: Conformational analysis and vibrational assignments from density functional theory calculations of the anharmonic fundamentals. The Journal of Physical Chemistry A, 119 (46). pp. 11280-11292. ISSN 1089-5639 (Print), 1520-5215 (Online) (doi:https://doi.org/10.1021/acs.jpca.5b07607)
raman
Chowdhry, Babur, Dines, Trevor, Mendham, Andrew and Ryall, John (2015) Infrared and raman spectroscopy of eugenol, isoeugenol, and methyl eugenol: Conformational analysis and vibrational assignments from density functional theory calculations of the anharmonic fundamentals. The Journal of Physical Chemistry A, 119 (46). pp. 11280-11292. ISSN 1089-5639 (Print), 1520-5215 (Online) (doi:https://doi.org/10.1021/acs.jpca.5b07607)