Перегляд за автором "Steinczinger, Z."

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An independent, general method for checking consistency between diffraction data and partial radial distribution functions derived from them: the example of liquid water

Steinczinger, Z.; Pusztai, L. (Condensed Matter Physics, 2012)

There are various routes for deriving partial radial distribution functions of disordered systems from experimental diffraction (and/or EXAFS) data. Due to limitations and errors of experimental data, as well as to ...
Comparison of the TIP4P-2005, SWM4-DP and BK3 interaction potentials of liquid water with respect to their consistency with neutron and X-ray diffraction data of pure water

Steinczinger, Z.; Pusztai, L. (Condensed Matter Physics, 2013)

Following a fairly comprehensive study on popular interaction potentials of water (Pusztai et al 2008, J. Chem. Phys., 129, 184103), here two more recent, polarizable potential sets, SWM4-DP (Lamoureux et al., Chem. Phys. ...

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