Publikationen von Mario R. Silva-Junior
Alle Typen
Zeitschriftenartikel (4)
2013
Zeitschriftenartikel
14 (13), S. 1648 - 1661 (2013)
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 2010
Zeitschriftenartikel
108, S. 453 - 465 (2010)
Basis set effects on coupled cluster benchmarks of electronically excited states: CC3, CCSDR(3) and CC2. Molecular Physics
Zeitschriftenartikel
133, 174318 (2010)
Benchmarks of electronically excited states: Basis set effects on CASPT2 results. Journal of Chemical Physics
Zeitschriftenartikel
6, S. 1546 - 1564 (2010)
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