Atte Sillanpää

Nuclear Magnetic Shielding and Quadrupole Coupling Tensors in Liquid Water:  A Combined Molecular Dynamics Simulation and Quantum Chemical Study

Teemu S. Pennanen, Juha Vaara, Perttu Lantto et al. · Journal of the American Chemical Society · 2004 · 62 citations

Quantum Liquid, Engineering, Magnetic Resonance +16

Interplay of Intrinsic, Environmental, and Dynamic Effects in Tuning the EPR Parameters of Nitroxides:  Further Insights from an Integrated Computational Approach

Michele Pavone, Paola Cimino, Orlando Crescenzi et al. · The Journal of Physical Chemistry B · 2007 · 58 citations

Magnetic Parameters, Engineering, Chemical Analysis +19

A Computational Study of Aluminum Hydroxide Solvation

Atte Sillanpää, Juha Päivärinta, Matti Hotokka et al. · The Journal of Physical Chemistry A · 2001 · 51 citations

Engineering, Computational Chemistry, Chemistry +19

Structural and Spectral Properties of Aqueous Hydrogen Fluoride Studied Using ab Initio Molecular Dynamics

Atte Sillanpää, Christian Simon, Michael L. Klein et al. · The Journal of Physical Chemistry B · 2002 · 50 citations

Engineering, Computational Chemistry, Chemistry +16

Density functional complexation study of metal ions with (amino) polycarboxylic acid ligands

Atte Sillanpää, Reijo Aksela, Kari Laasonen · Physical Chemistry Chemical Physics · 2003 · 40 citations

Inorganic Chemistry, Metal Ions, Polycarboxylic Acid Ligands +13