129 citations · 194 across the 4 of their papers we have counts for
5 papers
Krypton oxides under pressure
Patryk Zaleski-Ejgierd, Paweł Łata
Under high pressure, krypton, one of the most inert elements is predicted to become sufficiently reactive to form a new class of krypton compounds; krypton oxides. Using modern ab-…
Argon difluoride stabilized at high pressure
Dominik Kurzydłowski, Patryk Zaleski-Ejgierd
On account of the rapid development of noble gas chemistry in the past half-century both xenon and krypton compounds can now be isolated in macroscopic quantities. The same though…
High-pressure formation and stabilization of iridium hydrides
Patryk Zaleski-Ejgierd
A class of iridium hydrides, IrH_x (x=0.5, 1-4, 6), is calculated at ab-initio level using the DFT. A number of hydrides are predicted to stabilize in the excess hydrogen environme…
Relativity and the lead-acid battery
Rajeev Ahuja, Andreas Blomqvist, Peter Larsson +2
The energies of the solid reactants in the lead-acid battery are calculated ab initio using two different basis sets at non-relativistic, scalar relativistic, and fully relativisti…
Comparison of chain versus sheet crystal structures for cyanides CN ( = Cu-Au) and dicarbides C ( = Be-Ba; Zn-Hg). Alternatives to graphene ?
P. Zaleski-Ejgierd, P. Pyykkö, M. Hakala
The cyanides CN, =Cu, Ag, Au, have experimentally a structure with hexagonally packed, infinite --CN--CN- chains. Following our earlier study for AuCN, we now predict t…