Загрузки by TreaxmeA

Steven Miller et al- First principles calculation of rotational and ro-vibrational line strengths

James R. Henderson et al- Calculated ro-vibrationai spectrum of ^7-Li3^+ and ^7-Li2^6Li^+

S. Caprasecca et al- Multiple scattering approach to elastic electron collisions with molecular clusters

K.L. Baluja et al- Low-energy positron collisions with water

Steven Miller and Jonathan Tennyson- Calculated Rotational and Rovibrational Transitions in the Spectrum of H3^+

P. Zabawa et al- Identification of Deeply Bound Heteronuclear Molecules Using Pulsed Laser Depletion Spectroscopy

Stavros C. Farantos and Jonathan Tennyson- A Ro-Vibrational Study of Regular/Irregular Behaviour of the CO-Ar System

Jonathan Tennyson, Steven Miller and Brian T. Sutcliffe- Beyond Ro-vibrational Separation

Brian K Elza et al- Non-adiabaticity and other aspects of polarisation in positron-molecule scattering

B.T. Sutcliffe et al- An Effective Computational Approach to the Calculation of the Vibration-Rotation Spectra of Triatomic Molecules

Steven Miller and Jonathan Tennyson- Overtone Bands of H3^+

Steven Miller and Jonathan Tennyson- Reactive and Inelastic Collisions involving Molecules in Selected Vibrational States

Jonathan Tennyson et al- The Generation of Continuum Orbitals for Molecular R-Matrix Calculations Using Lagrange Orthogonolisation

I.W.M. Smith- Reactive and Inelastic Collisions involving Molecules in Selected Vibrational States

Brian T. Sutcliffe, Jonathan Tennyson and Steven Miller- The use of supercomputers for the variational calculation of ro-vibrationally excited states of floppy molecules

Roger I. Bickley and Venkataraman Vishwanathan- Photocatalytically induced fixation of molecular nitrogen by near UV radiation

Brian T. Sutcliffe and Jonathan Tennyson- Variational Methods for the Calculation of Rovibrational Energy Levels of Small Molecules

Steven Miller and Jonathan Tennyson- First Principles Calculation of the Molecular Constants of H3^+, H2D^+, D2H^+ and D3^+

Gábor Czakó et al- Finite basis representations with nondirect product basis functions having structure similar to that of spherical harmonics

Edit Mátyus et al- Vibrational energy levels with arbitrary potentials using the Eckart-Watson Hamiltonians and the discrete variable representation

Igor N. Kozin et al- Calculating the energy levels of isomerizing tetraatomic molecules

Tamas Szidarovszky, Attila G. Csaszar and Gabor Czako- On the efficiency of treating singularities in triatomic variational vibrational computations. The vibrational states of H3^+ up to dissociation

Alexander Gottlieb- Propagation of Molecular Chaos by Quantum Systems and the Dynamics of the Curie-Weiss Model

Alexander David Gottlieb- Markov Transitions and the Propagation of Chaos

Classical and Quantum Propagation of Chaos

Pierre-Francois Coheur et al- A 3000 K laboratory emission spectrum of water

Oleg L. Polyansky et al- High-Temperature Rotational Transitions of Water in Sunspot and Laboratory Spectra

Oleg L. Polyansky et al- Water on the Sun

O. N. Ulenikov et al- High-Resolution Fourier Transform Spectrum of HDO in the Region 6140–7040 cm^-1

R.C.M. Learner et al- The Contribution of Unknown Weak Water Vapor Lines to the Absorption of Solar Radiation

T. Parekunnel et al- Emission spectrum of hot HDO in the 380-2190cm^-1 region

Sergei V. Shirin et al- Spectroscopically determined potential energy surfaces of the H2^16O, H2^17O and H2^18O isotopologues of water

Andrew Janea et al- Emission spectrum of hot HDO below 4000cm^-1

Sergei V. Shirin et al- Analysis of hot D2O emission using specroscopically-determined potentials

Elena Bertseva, Olga Naumenko and Alain Campargue- The 5VOH Overtone Transition of HDO

N. F. Zobov et al- The near ultraviolet rotation-vibration spectrum of water

Oleg L. Polyansky et al- High-Accuracy Ab Initio Rotation-Vibration Transitions for Water

Peter F. Bernath- The spectroscopy of water vapour

Jonathan Tennyson et al- Experimental energy levels of the water molecule

R. Curık and Chris H. Greene- Indirect dissociative recombination of LiH^+ molecules fueled by complex resonance manifolds

Dun-Sheng Zheng and Guo-Zhen Wu- Significance of the Formal Quantum Number in the Highly Excited Vibration of the DCN Molecule

Falk Richter et al- Time-dependent Wavepacket Study on trans-cis Isomerization of HONO with an external field

Xinguo Liu et al- Semirigid vibrating rotor target calculation for reaction O(^3-P)+CH4→CH3+OH

Gabor Czako et al- Treating singularities present in the Sutcliffe-Tennyson vibrational Hamiltonian in orthogonal internal coordinates

Gabor Czako et al- Use of a nondirect-product basis for treating singularities in triatomic rotational–vibrational calculations

Guangju Chen and Ruozhuang Liu- Exact quantum mechanical vibration-rotation kinetic energy operator of four-particle system in various coordinates

Xiao-GangWang and Tucker Carrington Jr- Using simply contracted basis functions with the Lanczos algorithm to calculate vibrational spectra

John C. Light and Tucker Carrington Jr- Discrete Variable Representations and their Utilization