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Refinado por: assunto: Matéria Condensada remover
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1
Solvent effects on the UV-visible absorption spectrum of benzophenone in water a combined Monte Carlo quantum mechanics study including solute polarization
Solvent effects on the UV-visible absorption spectrum of benzophenone in water a combined Monte Carlo quantum mechanics study including solute polarization
Material Type:
Artigo 		Adicionar ao Meu Espaço

Solvent effects on the UV-visible absorption spectrum of benzophenone in water a combined Monte Carlo quantum mechanics study including solute polarization

H C Georg Kaline Rabelo Coutinho; Sylvio Canuto

Journal of Chemical Physics v. 126, n. 3, p. 034507/1-034507/8, 2007

Menasha 2007

Acesso online

2
Solvent effects on the UV-visible absorption spectrum of benzophenone in water a combined Monte Carlo quantum mechanics study including solute polarization
Solvent effects on the UV-visible absorption spectrum of benzophenone in water a combined Monte Carlo quantum mechanics study including solute polarization
Material Type:
Artigo 		Adicionar ao Meu Espaço

Solvent effects on the UV-visible absorption spectrum of benzophenone in water a combined Monte Carlo quantum mechanics study including solute polarization

H C Georg Kaline Rabelo Coutinho; Sylvio Canuto

Journal of Chemical Physics v. 126, n. 3, p. 034507/1-034507/8, 2007

Menasha 2007

Acesso online

3
Combining ab initio multiconØgurational calculations and the Free energy gradient method to obtain the excited state structure of uracil in solution
Combining ab initio multiconØgurational calculations and the Free energy gradient method to obtain the excited state structure of uracil in solution
Material Type:
Artigo de Congresso 		Adicionar ao Meu Espaço

Combining ab initio multiconØgurational calculations and the Free energy gradient method to obtain the excited state structure of uracil in solution

Carlos Bistafa Herbert C Georg; Sylvio Roberto Accioly Canuto; Encontro Nacional de Física da Matéria Condensada (37 2014 Costa do Sauípe, BA)

SBF São Paulo: Sociedade Brasileira de Física(2014)

São Paulo 2014

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4
Applying many-body expansion aiming to make Ab initio molecular dynamics more efficient
Applying many-body expansion aiming to make Ab initio molecular dynamics more efficient
Material Type:
Artigo de Congresso 		Adicionar ao Meu Espaço

Applying many-body expansion aiming to make Ab initio molecular dynamics more efficient

Vinícius Wilian Dias Cruzeiro H. C Georg; Encontro Nacional de Física da Matéria Condensada (XXXVI 2013 Águs de Lindóia, SP)

SBF Resumos

Águas de Lindóia SBF 2013

Acesso online

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  1. Método De Monte Carlo  (3)
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Deste Autor:

  1. Georg, H
  2. Canuto, S
  3. Encontro Nacional de Física da Matéria Condensada
  4. Coutinho, K
  5. Bistafa, C

Neste Assunto:

  1. Método De Monte Carlo
  2. Métodos Mcmc

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

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