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37 results on '"Lee, Timothy J."'

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4. Search for stratospheric bromine reservoir species: Theoretical study of the photostability of mono-, tri-, and pentacoordinated bromine compounds

7. Identifying the molecular origin of global warming

11. Quantum Chemical Analysis of the CO-HNN+ Proton-Bound Complex.

21. Highly Accurate Quartic Force Fields, Vibrational Frequencies, and Spectroscopic Constants for Cyclic and Linear C3H3+.

22. Structure, Anharmonic Vibrational Frequencies, and Intensities of NNHNN+.

23. Ames-2021 CO 2 Dipole Moment Surface and IR Line Lists: Toward 0.1% Uncertainty for CO 2 IR Intensities.

24. Fundamental Vibrational Frequencies and Spectroscopic Constants of Substituted Cyclopropenylidene (c-C 3 HX, X = F, Cl, CN).

25. Climate Metrics for C1-C4 Hydrofluorocarbons (HFCs).

26. Cation, Anion, and Radical Isomers of C 4 H 4 N: Computational Characterization and Implications for Astrophysical and Planetary Environments.

27. Highly Accurate Quartic Force Field and Rovibrational Spectroscopic Constants for the Azirinyl Cation (c-C 2 NH 2 + ) and Its Isomers.

28. Quantum Chemical Analysis of the CO-HNN + Proton-Bound Complex.

29. Structure, Anharmonic Vibrational Frequencies, and Intensities of NNHNN(+).

30. Formation and stability of C₆H₃⁺ isomers.

31. Quartic force field rovibrational analysis of protonated acetylene, C2H3(+), and its isotopologues.

32. Vibrational frequencies and spectroscopic constants for 1 3A' HNC and 1 3A' HOC+ from high-accuracy quartic force fields.

33. The 1 3A' HCN and 1 3A' HCO+ vibrational frequencies and spectroscopic constants from quartic force fields.

34. Dipole surface and infrared intensities for the cis- and trans-HOCO and DOCO radicals.

35. Fundamental vibrational frequencies and spectroscopic constants of HOCS+, HSCO+, and isotopologues via quartic force fields.

36. Highly accurate quartic force fields, vibrational frequencies, and spectroscopic constants for cyclic and linear C3H3(+).

37. An approach to include the effects of diffuse functions in potential energy surface calculations.

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