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11 Publications


2024 | Journal Article | LibreCat-ID: 56679
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.
LibreCat | DOI
 

2022 | Journal Article | LibreCat-ID: 40425
Microscopic Study of Molecular Double Doping
T. Bathe, C.-D. Dong, S. Schumacher, The Journal of Physical Chemistry A 126 (2022) 2075–2081.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 33644
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.
LibreCat | DOI
 

2021 | Journal Article | LibreCat-ID: 41326
Determination of Crystal-Field Splitting Induced by Thermal Oxidation of Titanium
K. Wojtaszek, W. Błachucki, K. Tyrała, M. Nowakowski, M. Zaja̧c, J. Stȩpień, P. Jagodziński, D. Banaś, W. Stańczyk, J. Czapla-Masztafiak, W.M. Kwiatek, J. Szlachetko, A. Wach, The Journal of Physical Chemistry A 125 (2021) 50–56.
LibreCat | DOI
 

2019 | Journal Article | LibreCat-ID: 16320
Experimental and Theoretical High Energy Resolution Hard X-ray Absorption and Emission Spectroscopy on Biomimetic Cu2S2 Complexes
P. Müller, A. Neuba, U. Flörke, G. Henkel, T.D. Kühne, M. Bauer, The Journal of Physical Chemistry A (2019) 3575–3581.
LibreCat | DOI
 

2014 | Journal Article | LibreCat-ID: 15861
Optical Spectroscopy of Graphene Quantum Dots: The Case of C132
H. Riesen, C. Wiebeler, S. Schumacher, The Journal of Physical Chemistry A (2014) 5189–5195.
LibreCat | DOI
 

2014 | Journal Article | LibreCat-ID: 15862
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.
LibreCat | DOI
 

2010 | Journal Article | LibreCat-ID: 41262
The Chemical Information Contained in the EXAFS Debye−Waller Factor: Covalency in Iron(III) Bis-diketonato Complexes
M. Bauer, The Journal of Physical Chemistry A 114 (2010) 12870–12874.
LibreCat | DOI
 

2002 | Journal Article | LibreCat-ID: 22623
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.
LibreCat | DOI
 

2002 | Journal Article | LibreCat-ID: 22624
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.
LibreCat | DOI
 

2002 | Journal Article | LibreCat-ID: 22626
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.
LibreCat | DOI
 

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