TY - GEN AU - Boussouf,K AU - Khairat,T AU - Prakash,M AU - Komiha,N AU - Chambaud,G AU - Hochlaf,M TI - Structure, Spectroscopy, and Bonding within the Zn(q+)-Imidazole(n) (q = 0, 1, 2; n = 1-4) Clusters and Implications for Zeolitic Imidazolate Frameworks and Zn-Enzymes SN - 1520-5215 PY - 2016///0913 KW - Computer Simulation KW - Coordination Complexes KW - chemistry KW - Enzymes KW - Imidazoles KW - Models, Molecular KW - Quantum Theory KW - Zinc N1 - Publication Type: Journal Article; Research Support, Non-U.S. Gov't UR - https://doi.org/10.1021/acs.jpca.5b09500 ER -