Willian R. Rocha

According to our database, Willian R. Rocha authored at least 5 papers between 1997 and 2011.

Collaborative distances:

• Dijkstra number of six.
• Erdős number of five.

2011

C--H bond activation of methane in aqueous solution: A hybrid quantum mechanical/effective fragment potential study.

Júlio C. S. da Silva, Willian R. Rocha

J. Comput. Chem., 2011

2010

DFT study of the full catalytic cycle for the propene hydroformylation catalyzed by a heterobimetallic HPt(SnCl₃)(PH₃)₂ model catalyst.

Júlio C. S. da Silva, Roberta P. Dias, Wagner B. De Almeida, Willian R. Rocha

J. Comput. Chem., 2010

2000

Carbonyl insertion reaction into the PtC bond in heterobimetallic Pt(SnCl3)(PH3)2(CO)(CH3) compound: Theoretical study.

Willian R. Rocha, Wagner B. De Almeida

J. Comput. Chem., 2000

1998

Ab initio conformational analysis of cyclooctane molecule.

Willian R. Rocha, Josefredo R. Pliego Jr., Stella M. Resende, Hélio F. Dos Santos, Marcos A. De Oliveira, Wagner B. De Almeida

J. Comput. Chem., 1998

1997

Quantum-mechanical and molecular mechanics conformational analysis of 1, 5-cyclooctadiene.

Willian R. Rocha, Wagner B. De Almeida

J. Comput. Chem., 1997