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Andreas J. Thorvaldsen

University of Tromsø

27

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2017 Reaction Chemistry and Engineering
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DALTON2015 { lsDalton Program Manual

2015
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Analytic cubic and quartic force fields using density-functional theory

2014 Journal of Chemical Physics
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Analytic density functional theory calculations of pure vibrational hyperpolarizabilities: The first dipole hyperpolarizability of retinal and related molecules

2014 Journal of Physical Chemistry A
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A general toolbox for the calculation of higher-order molecular properties using SCF wave functions at the one-, two- and four-component levels of theory

2012
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Efficient calculation of ROA tensors with analytical gradients and fragmentation.

2012 Chirality
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Hyper Raman spectra calculated in a time-dependent Hartree-Fock method

2012 Molecular Physics
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The ab initio calculation of molecular electric, magnetic and geometric properties

2011 Physical Chemistry Chemical Physics
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Comparison of standard and damped response formulations of magnetic circular dichroism

2011 Journal of Chemical Physics
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Gauge-origin independent calculations of Jones birefringence

2011 Journal of Chemical Physics
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