A sequential Monte Carlo quantum mechanics study of the hydrogen-bond interaction and the solvatochromic shift of the n-"pi" transition of acrolein in water
Herbert de Castro Georg Kaline Rabelo Coutinho; Sylvio Canuto
Journal of Chemical Physics v. 123, n. 12, p. 124307/1-124307/8, 2005New York 2005
Acesso online