Publications of Mario R. Silva-Junior

Silva-Junior, M. R.; Mansurova, M.; Gärtner, W.; Thiel, W.: Photophysics of Structurally Modified Flavin Derivatives in the Blue-Light Photoreceptor YtvA: A Combined Experimental and Theoretical Study. ChemBioChem: A European Journal of Chemical Biology 14 (13), pp. 1648 - 1661 (2013)

Silva-Junior, M. R.; Sauer, S. P. A.; Schreiber, M.; Thiel, W.: Basis set effects on coupled cluster benchmarks of electronically excited states: CC3, CCSDR(3) and CC2. Molecular Physics 108, pp. 453 - 465 (2010)

Silva-Junior, M. R.; Schreiber, M.; Sauer, S. P. A.; Thiel, W.: Benchmarks of electronically excited states: Basis set effects on CASPT2 results. Journal of Chemical Physics 133, 174318 (2010)

Silva-Junior, M. R.; Thiel, W.: Benchmark of Electronically Excited States for Semiempirical Methods: MNDO, AM1, PM3, OM1, OM2, OM3, INDO/S, and INDO/S2. Journal of Chemical Theory and Computation 6, pp. 1546 - 1564 (2010)