Ontology highlight
ABSTRACT:
SUBMITTER: Savateev A
PROVIDER: S-EPMC7496904 | biostudies-literature | 2020 Aug
REPOSITORIES: biostudies-literature
Savateev Aleksandr A Tarakina Nadezda V NV Strauss Volker V Hussain Tanveer T Hussain Tanveer T Ten Brummelhuis Katharina K Sánchez Vadillo José Manuel JM Markushyna Yevheniia Y Mazzanti Stefano S Tyutyunnik Alexander P AP Walczak Ralf R Oschatz Martin M Guldi Dirk M DM Karton Amir A Antonietti Markus M
Angewandte Chemie (International ed. in English) 20200609 35
Polymeric carbon nitride materials have been used in numerous light-to-energy conversion applications ranging from photocatalysis to optoelectronics. For a new application and modelling, we first refined the crystal structure of potassium poly(heptazine imide) (K-PHI)-a benchmark carbon nitride material in photocatalysis-by means of X-ray powder diffraction and transmission electron microscopy. Using the crystal structure of K-PHI, periodic DFT calculations were performed to calculate the densit ...[more]