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passamm documents
Documents
Andres Garcia Ayllon et al- Calculated spectra for the N2-Ar van der Waais complex
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John A. Fernley et al- Band Origins for Water up to 22 000 cm^-1 : A Comparison of Spectroscopically Determined Potential Energy Surfaces
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Jonathan Tennyson and Brian T. Sutcliffe- Discretization to Avoid Singularities in Vibration-Rotation Hamiltonians: A Bisector Embedding for AB2 Triatomics
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Jonathan Tennyson and Steven Miller- Calculating Molecular Spectra
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Michael Berblinger and Christoph Schlier- Accurate specific molecular state densities by phase space integration. I. Computational method
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Steven Miller and Jonathan Tennyson- H3^+ in Space
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James R. Henderson, Hoanh A. Lam and Jonathan Tennyson- Highly Excited Vibrational States of the KCN Molecule
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Bianca M. Dinelli et al- Bands of H3^+ up to 4-nu-2 Rovibrational Transitions from First Principles Calculations
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Oleg L. Polyansky and Jonathan Tennyson- On the Convergence of Effective Hamiltonian Expansions
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C. Ruth Le Sueuer et al- On the use of variational wavefunctions in calculating vibrational band intensities
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Jonathan Tennyson- Why Calculate the Spectra of Small Molecules?
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James R. Henderson et al- Coordinate ordering in the discrete variable representation
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James R. Henderson and Jonathan Tennyson- DVR1D: programs for mixed pointwise/ basis set calculation of ro-vibrational spectra
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James R. Henderson, C. Ruth Le Sueur and Jonathan Tennyson- DVR3D: programs for fully pointwise calculation of vibrational spectra
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C. Ruth Le. Sueur, James R. Henderson and Jonathan Tennyson- Gateway states and bath states in the vibrational spectrum of H3^+
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Jonathan Tennyson, Steven Miller and Hans Schild- First-principles Calculations on the Astrochemistry and Spectroscopy of H3^+
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M. E. Bannister et al- Absolute cross sections for near-threshold electron-impact excitation of the 2s^2S->2p^2 P transition in C^3+
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Stuart Carter et al- Benchmark Calculations of First Principles Rotational and Ro-Vibrational Line Strengths
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Jonathan Tennyson and Steven Miller- A Program Suite for the Calculation of Ro-Vibrational Spectra of Triatomic Molecules
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Steven Miller and Jonathan Tennyson- Hot Band Transition Frequencies and Line Strengths in H3^+: First Principles Calculations
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James R. Henderson and Jonathan Tennyson- Very highly excited vibrational states of LiCN using a discrete variable representation
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