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Electronic properties of liquid ammonia a sequential molecular dynamics/quantum mechanics approach
Electronic properties of liquid ammonia a sequential molecular dynamics/quantum mechanics approach
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Electronic properties of liquid ammonia a sequential molecular dynamics/quantum mechanics approach

Tania S Almeida Kaline Rabelo Coutinho; Benedito J Costa Cabral; Sylvio Canuto

Journal of Chemical Physics v. 128, n. 1, p. 014506/1-014506/9, 2008

New York 2008

Acesso online

2
Electronic properties of liquid ammonia a sequential molecular dynamics/quantum mechanics approach
Electronic properties of liquid ammonia a sequential molecular dynamics/quantum mechanics approach
Material Type:
Artigo 		Adicionar ao Meu Espaço

Electronic properties of liquid ammonia a sequential molecular dynamics/quantum mechanics approach

Tania S Almeida Kaline Rabelo Coutinho; Benedito J Costa Cabral; Sylvio Canuto

Journal of Chemical Physics v. 128, n. 1, p. 014506/1-014506/9, 2008

New York 2008

Acesso online

3
Ab initio calculation of hydrogen bonds in liquids a sequential Monte Carlo quantum mechanics study of pyridine in water
Ab initio calculation of hydrogen bonds in liquids a sequential Monte Carlo quantum mechanics study of pyridine in water
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Ab initio calculation of hydrogen bonds in liquids a sequential Monte Carlo quantum mechanics study of pyridine in water

Thaciana Malaspina Kaline Rabelo Coutinho; Sylvio Canuto

Journal of Chemical Physics Melville v. 117, n. 4, p. 1692-1699, 2002

Melville 2002

Acesso online

4
Ab initio calculation of hydrogen bonds in liquids a sequential Monte Carlo quantum mechanics study of pyridine in water
Ab initio calculation of hydrogen bonds in liquids a sequential Monte Carlo quantum mechanics study of pyridine in water
Material Type:
Artigo 		Adicionar ao Meu Espaço

Ab initio calculation of hydrogen bonds in liquids a sequential Monte Carlo quantum mechanics study of pyridine in water

Thaciana Malaspina Kaline Rabelo Coutinho; Sylvio Canuto

Journal of Chemical Physics Melville v. 117, n. 4, p. 1692-1699, 2002

Melville 2002

Acesso online

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Assunto 

  1. Espectroscopia Molecular  (2)
  2. Métodos Mcmc  (2)
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  1. Malaspina, T  (2)
  2. Almeida, T  (2)
  3. Cabral, B  (2)
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Deste Autor:

  1. Coutinho, K
  2. Canuto, S
  3. Malaspina, T
  4. Almeida, T
  5. Cabral, B

Neste Assunto:

  1. Método De Monte Carlo
  2. Espectroscopia Molecular
  3. Métodos Mcmc

  • Realização: ABCD-USP USP   Logos de Redes Sociais: Freepik

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