Pang, B.; Iqbal, D.; Sarfraz, A.; Biedermann, P. U.; Erbe, A.: Differences in perchlorate adsorption to azobenzene monolayers on gold formed from thioacetate and thiol precursors. Zeitschrift für physikalische Chemie 236 (10) (2022)
Pang, B.; Stratmann, M.; Vogel, D.; Erbe, A.; Rohwerder, M.: Characterization of electrochemical double layer formed on Au (111) electrode: a KPM, FTIR and APXPS investigation. 2nd Annual APXPS Workshop, Berkeley, CA, USA (2015)
Pang, B.: Synthesis of photosensitive molecules and characterization of their adsorbates on Au(111) Surface. Master, Faculty of Chemistry and Biochemistry, Ruhr University Bochum, Bochum, Germany (2014)
Max Planck scientists design a process that merges metal extraction, alloying and processing into one single, eco-friendly step. Their results are now published in the journal Nature.
While Density Functional Theory (DFT) is in principle exact, the exchange functional remains unknown, which limits the accuracy of DFT simulation. Still, in addition to the accuracy of the exchange functional, the quality of material properties calculated with DFT is also restricted by the choice of finite bases sets.