Computational Research Data for: "Sterically Demanding Macrocyclic Eu(III) Complexes for Selective Recognition of Phosphate and Adenosine Monophosphate" by Felix Plasser

“…Each folder contains the converged geometries for- Eu*_free.xyz - free complex- Eu*_water.xyz - one bound water molecule- Eu*BOH3.xyz - OH- bound- Eu*_Pi.xyz - inorganic phosphate bound- Eu*AMP.xyz - AMP bound- EumBOH_AMP_cyclic.xyz - cyclic structure (meta only)The input files are shown in the folder INPUT- qchem.in - general input file to Q-Chem- 6-31G.bas/6-31G.pol - extra basis set definition for Eu in QCAUX…”
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Electrochemistry of the porous lead electrode by John B. Lakeman

“…These effects promoted an increased utilisation of-,tbe electrode active material on discharge. BaS04 was found to provide nucleation centres for PbS04 formation. …”
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