Structural, energetic, and spectroscopic aspects of arsenic-containing compounds: a theoretical approach

• Grant number: 10/00778-3
• Support Opportunities: Scholarships in Brazil - Doctorate
• Start date: May 01, 2010
• End date: March 31, 2014
• Field of knowledge: Physical Sciences and Mathematics - Chemistry - Physical-Chemistry
• Principal Investigator: Fernando Rei Ornellas
• Grantee: Ana Paula de Lima Batista
• Host Institution: Instituto de Química (IQ). Universidade de São Paulo (USP). São Paulo , SP, Brazil

Scientific publications

(References retrieved automatically from Web of Science and SciELO through information on FAPESP grants and their corresponding numbers as mentioned in the publications by the authors)

DE LIMA BATISTA, ANA PAULA; DE OLIVEIRA-FILHO, ANTONIO G. S.; ORNELLAS, FERNANDO R.. Ab initio characterization of the lowest-lying electronic states of the NaAs molecule. COMPUTATIONAL AND THEORETICAL CHEMISTRY, v. 1064, p. 56-61, JUL 15 2015. (12/18489-3, 10/00778-3)

Academic Publications

(References retrieved automatically from State of São Paulo Research Institutions)

BATISTA, Ana Paula de Lima. Theoretical study of the CAs radical and of the adsorption of As and AsH3 on diamond C(100) surface. 2014. Doctoral Thesis - Universidade de São Paulo (USP). Conjunto das Químicas (IQ e FCF) (CQ/DBDCQ) São Paulo.