On the Theoretical Quantification of Radii of Atoms in Molecules
A. Alibakhshi, L.V. Schäfer, The Journal of Physical Chemistry A 128 (2024) 6819–6823.

Microscopic Study of Molecular Double Doping
T. Bathe, C.-D. Dong, S. Schumacher, The Journal of Physical Chemistry A 126 (2022) 2075–2081.

Organic Mixed-Valence Compounds and the Overhauser Effect in Insulating Solids
S. Pylaeva, P. Marx, G. Singh, T. Kühne, M. Roemelt, H. Elgabarty, The Journal of Physical Chemistry A 125 (2021) 867–874.

Determination of Crystal-Field Splitting Induced by Thermal Oxidation of Titanium
K. Wojtaszek, W. Bachucki, K. Tyraa, M. Nowakowski, M. Zajac, J. Stpie, P. Jagodziski, D. Banab, W. Staczyk, J. Czapla-Masztafiak, W.M. Kwiatek, J. Szlachetko, A. Wach, The Journal of Physical Chemistry A 125 (2021) 50–56.

Experimental and Theoretical High Energy Resolution Hard X-ray Absorption and Emission Spectroscopy on Biomimetic Cu2 Complexes
P. Müller, A. Neuba, U. Flörke, G. Henkel, T.D. Kühne, M. Bauer, The Journal of Physical Chemistry A (2019) 3575–3581.

Optical Spectroscopy of Graphene Quantum Dots: The Case of 2
H. Riesen, C. Wiebeler, S. Schumacher, The Journal of Physical Chemistry A (2014) 5189–5195.

Quantum Yields and Reaction Times of Photochromic Diarylethenes: Nonadiabatic Ab Initio Molecular Dynamics for Normal- and Inverse-Type
C. Wiebeler, S. Schumacher, The Journal of Physical Chemistry A (2014) 7816–7823.

Optical Excitations in Star-Shaped Fluorene Molecules
N.A. Montgomery, J.-C. Denis, S. Schumacher, A. Ruseckas, P.J. Skabara, A. Kanibolotsky, M.J. Paterson, I. Galbraith, G.A. Turnbull, I.D.W. Samuel, The Journal of Physical Chemistry A 115 (2011) 2913–2919.

The Chemical Information Contained in the EXAFS DebyeWaller Factor: Covalency in Iron(III) Bis-diketonato Complexes
M. Bauer, The Journal of Physical Chemistry A 114 (2010) 12870–12874.

Fast Processes in a N2O-Modulated Hollow Cathode Discharge: Excitation and Diffusion
M.T. de los Arcos de Pedro, M. Castillo, C. Domingo, V.J. Herrero, M.M. Sanz, I. Tanarro, The Journal of Physical Chemistry A (2002) 8183–8193.

Diagnostics and Kinetic Modeling of the Ignition and the Extinction Transients of a Hollow Cathode N2O Discharge
M.T. de los Arcos de Pedro, C. Domingo, V.J. Herrero, M.M. Sanz, I. Tanarro, The Journal of Physical Chemistry A (2002) 3974–3983.

Diagnostics and Kinetic Modeling of a Hollow Cathode N2O Discharge
M.T. de los Arcos de Pedro, C. Domingo, V.J. Herrero, M.M. Sanz, A. Schulz, I. Tanarro, The Journal of Physical Chemistry A (2002) 6282–6291.