Search Results - "Kraemer, WP"
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The Renner effect in triatomic molecules with application to CH2+, MgNC and NH2
Published in Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy (01-03-2002)Get full text
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Transition moments and NH2 cometary spectra
Published in Molecular physics (20-02-2003)“…We calculate vibronic transition moments for the A −2 A 1- X −2 , electronic band system, and for the vibrational transitions within the à and [Xtilde] states,…”
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New rotation–vibration band and potential energy function of NeH + in the ground electronic state
Published in Journal of molecular structure (30-06-2004)“…The Fourier transform emission spectrum of 20NeH + in its 1Σ + ground electronic state was observed in the infrared spectral region at an apodized resolution…”
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A theoretical calculation of the absorption spectrum of CH2
Published in Chemical physics (15-12-1997)Get full text
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Vibrational linestrengths for the ground and first excited electronic states of HeH2
Published in Theoretical chemistry accounts (01-10-2003)Get full text
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Bound and low-lying quasi-bound rotation–vibration energy levels of the ground and first excited electronic states of HeH2
Published in Chemical physics (15-02-2002)Get full text
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Coulomb explosion imaging: the CH2+, H2O+ and NH2+ ions as benchmarks
Published in Chemical physics letters (03-03-2000)Get full text
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Coulomb explosion imaging and the CH2+ molecule
Published in Chemical physics letters (13-08-1999)Get full text
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On the Thermodynamic Stability of ArO4
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (14-10-1999)“…The argon tetroxide molecule, ArO4, and the isoelectronically associated perchlorate, , and sulfate, , ions are investigated on different levels of ab initio…”
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Formation of HeH + by radiative association of He + + H. An advanced ab initio study
Published in Chemical physics letters (07-04-1995)“…Rate coefficients of all possible radiative association reactions for He + + H are calculated over a wide temperature range. For this purpose the potential…”
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An ab initio calculation of the rovibronic energies of the BH2 molecule
Published in Molecular physics (01-05-1996)“…The [Xtilde] 2 A 1 and à 2 B 1 electronic states of the BH 2 molecule become degenerate ( 2 Π) when the molecule is linear and the electronic angular momentum…”
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13
Predicted rovibronic spectra of CH2+ and CD2
Published in Chemical physics letters (22-06-2001)Get full text
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The spectrum of singlet SiH2
Published in Canadian journal of chemistry (01-06-2004)“…We report a theoretical study of the two lowest singlet electronic states ( 1 A 1 and à 1 B 1 ) of silylene SiH 2 . These states become degenerate as a 1 Δ g…”
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Rovibrational Energies of Triatomic Molecules by Means of the Rayleigh–Schrödinger Perturbation Theory
Published in Journal of molecular spectroscopy (01-02-2000)“…A Rayleigh–Schrödinger perturbation theory approach based on the adiabatic (Born–Oppenheimer) separation of vibrational motions was previously developed and…”
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Classical and Quantum-Mechanical Calculations of HCO+ + e → CO(v) + H
Published in The Astrophysical journal (10-05-1998)Get full text
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A Treatment of the Renner Effect Using the MORBID Hamiltonian
Published in Journal of molecular spectroscopy (01-05-1995)“…For a triatomic molecule, we develop the rovibronic Hamiltonian, basis functions, and matrix elements necessary to allow us to determine the energy levels and…”
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18
An ab Initio Study of the NH2+ Absorption Spectrum
Published in Journal of molecular spectroscopy (01-12-1997)“…In a previous publication (1997. P. Jensen, J. Mol. Spectrosc. 181, 207-214), rotation-vibration energy levels for the electronic ground state X3B1 of the…”
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The Matrix Isolation Spectrum of the CH2+ Ion
Published in Journal of molecular spectroscopy (01-12-2002)Get full text
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Ab Initio Calculated Rotation-Vibration Line Strengths for the (vHH = 0 --> 1 ) Transition of HeH+2
Published in Journal of molecular spectroscopy (01-02-1998)Get full text
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