Proton-transfer dynamics in the (HCO3-)2 dimer of KHCO3 from Car-Parrinello and path-integrals molecular dynamics calculations.
Dopieralski
Przemyslaw D
PD
University of Wroclaw, Faculty of Chemistry, 14 Joliot-Curie Str. 50-383 Wroclaw, Poland. mclar@elrond.chem.uni.wroc.pl
Latajka
Zdzislaw
Z
Olovsson
Ivar
I