skip to main content
Idioma:
Primo Advanced Search
Primo Advanced Search Query Term
Primo Advanced Search Query Term
Primo Advanced Search Query Term
Primo Advanced Search prefilters
Busca Simples
Resultados 1 2 3 4 5 next page
Refinado por: Nome da Publicação: International Journal Of Quantum Chemistry remover idioma: Alemão remover nível superior: Revistas revisadas por pares remover
Result Number Material Type Add to My Shelf Action Record Details and Options
1
Scattering state of the multiparameter potential with an improved approximation for the centrifugal term in D-dimensions
Scattering state of the multiparameter potential with an improved approximation for the centrifugal term in D-dimensions
Material Type:
Artigo 		Adicionar ao Meu Espaço

Scattering state of the multiparameter potential with an improved approximation for the centrifugal term in D-dimensions

Ikot, Akpan N. ; Ibanga, Eno J. ; Hassanabadi, Hassan

International journal of quantum chemistry, 2016-01, Vol.116 (2), p.81-87 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

Texto completo disponível

Citações Citado por
2
Arbitrary l-wave bound states of the Schrödinger equation for the hyperbolical molecular potential
Arbitrary l-wave bound states of the Schrödinger equation for the hyperbolical molecular potential
Material Type:
Artigo 		Adicionar ao Meu Espaço

Arbitrary l-wave bound states of the Schrödinger equation for the hyperbolical molecular potential

Wei, Gao-Feng ; Chen, Wen-Li

International journal of quantum chemistry, 2014-12, Vol.114 (23), p.1602-1606 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

Texto completo disponível

Citações Citado por
3
Structuring and destructuring effects along a pathway toward formation of zwitterionic glycine···(H2O)2 complex: many body analysis of clusters and molecular electrostatic potential investigations
Structuring and destructuring effects along a pathway toward formation of zwitterionic glycine···(H2O)2 complex: many body analysis of clusters and molecular electrostatic potential investigations
Material Type:
Artigo 		Adicionar ao Meu Espaço

Structuring and destructuring effects along a pathway toward formation of zwitterionic glycine···(H2O)2 complex: many body analysis of clusters and molecular electrostatic potential investigations

Kulkarni, Anant D. ; Rai, Dhurba ; Gejji, Shridhar P. ; Bartolotti, Libero J. ; Pathak, Rajeev K.

International journal of quantum chemistry, 2013-05, Vol.113 (9), p.1325-1332 [Periódico revisado por pares]

Hoboken: Wiley Subscription Services, Inc., A Wiley Company

Texto completo disponível

Citações Citado por
4
Electronic properties of polyoxometalate derivatives [(C2B9H11) M'M5O18]n- (M' = TiIV, MoVI, WVI; M = MoVI, WVI): Protonation, Electronic Spectra, and Redox Properties
Electronic properties of polyoxometalate derivatives [(C2B9H11) M'M5O18]n- (M' = TiIV, MoVI, WVI; M = MoVI, WVI): Protonation, Electronic Spectra, and Redox Properties
Material Type:
Artigo 		Adicionar ao Meu Espaço

Electronic properties of polyoxometalate derivatives [(C2B9H11) M'M5O18]n- (M' = TiIV, MoVI, WVI; M = MoVI, WVI): Protonation, Electronic Spectra, and Redox Properties

Ma, Nana ; Li, Shujun ; Yan, Likai ; Wang, Wenyong ; Qiu, Yongqing ; Zhang, Guisheng

International journal of quantum chemistry, 2016-03, Vol.116 (5), p.396-404 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

Texto completo disponível

Citações Citado por
5
Potential energy surface as a key to understanding the structure and properties of short-living radical ions of cyclic organic molecules
Potential energy surface as a key to understanding the structure and properties of short-living radical ions of cyclic organic molecules
Material Type:
Artigo 		Adicionar ao Meu Espaço

Potential energy surface as a key to understanding the structure and properties of short-living radical ions of cyclic organic molecules

Shchegoleva, Lyudmila N. ; Beregovaya, Irina V.

International journal of quantum chemistry, 2016-02, Vol.116 (3), p.161-173 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

Texto completo disponível

Citações Citado por
6
Intermolecular interactions of formic acid with benzene: Energy decomposition analyses with ab initio MP2 and double-hybrid density functional computations
Intermolecular interactions of formic acid with benzene: Energy decomposition analyses with ab initio MP2 and double-hybrid density functional computations
Material Type:
Artigo 		Adicionar ao Meu Espaço

Intermolecular interactions of formic acid with benzene: Energy decomposition analyses with ab initio MP2 and double-hybrid density functional computations

Yu, Feng

International journal of quantum chemistry, 2013-11, Vol.113 (21), p.2355-2360 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

Texto completo disponível

Citações Citado por
7
Highly accurate benchmark calculations of the interaction energies in the complexes C6H6···C6X6 (X = F, Cl, Br, and I)
Highly accurate benchmark calculations of the interaction energies in the complexes C6H6···C6X6 (X = F, Cl, Br, and I)
Material Type:
Artigo 		Adicionar ao Meu Espaço

Highly accurate benchmark calculations of the interaction energies in the complexes C6H6···C6X6 (X = F, Cl, Br, and I)

Wang, Weizhou ; Zhang, Yu ; Wang, Yi‐Bo

International journal of quantum chemistry, 2017-04, Vol.117 (7), p.n/a [Periódico revisado por pares]

Hoboken: Wiley Subscription Services, Inc

Texto completo disponível

Citações Citado por
8
Functional dependence of excitation energy for pentacene/C60 model complex in the nonempirically tuned long-range corrected density functional theory
Functional dependence of excitation energy for pentacene/C60 model complex in the nonempirically tuned long-range corrected density functional theory
Material Type:
Artigo 		Adicionar ao Meu Espaço

Functional dependence of excitation energy for pentacene/C60 model complex in the nonempirically tuned long-range corrected density functional theory

Minami, Takuya ; Ito, Soichi ; Nakano, Masayoshi

International journal of quantum chemistry, 2013-02, Vol.113 (3), p.252-256 [Periódico revisado por pares]

Hoboken: Wiley Subscription Services, Inc., A Wiley Company

Texto completo disponível

Citações Citado por
9
Density functional studies of the structural variety of the Cu2S2 core of the CuA site
Density functional studies of the structural variety of the Cu2S2 core of the CuA site
Material Type:
Artigo 		Adicionar ao Meu Espaço

Density functional studies of the structural variety of the Cu2S2 core of the CuA site

Takano, Yu ; Okuyama, Orio ; Shigeta, Yasuteru ; Nakamura, Haruki

International journal of quantum chemistry, 2012-12, Vol.112 (24), p.3756-3762 [Periódico revisado por pares]

Hoboken: Wiley Subscription Services, Inc., A Wiley Company

Texto completo disponível

Citações Citado por
10
Optimal cloud use of quartic force fields: The first purely commercial cloud computing based study for rovibrational analysis of SiCH
Optimal cloud use of quartic force fields: The first purely commercial cloud computing based study for rovibrational analysis of SiCH
Material Type:
Artigo 		Adicionar ao Meu Espaço

Optimal cloud use of quartic force fields: The first purely commercial cloud computing based study for rovibrational analysis of SiCH

Fortenberry, Ryan C. ; Thackston, Russell

International journal of quantum chemistry, 2015-12, Vol.115 (23), p.1650-1657 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

Texto completo disponível

Citações Citado por
Resultados 1 2 3 4 5 next page

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

Buscando em bases de dados remotas. Favor aguardar.