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Artigo de periodico
Interactions between 1-butyl-3-methylimidazolium tetrafluoroborate ionic liquid and 'gama'-'Al IND.2''O IND.3' (100) surface calculated by density functional theory (2012)
Martins, Mateus J. F.; Ferreira, Ary R.; Konstantinova, Elena; Abreu, Heitor A. de; Souza, Wladimir F.; Chiaro, Sandra S. X.; Dias, Luís Gustavo; Leitão, Alexandre A.
Source: International Journal of Quantum Chemistry. Unidade: FFCLRP
Assunto: QUÍMICA
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ABNT
MARTINS, Mateus J. F. et al. Interactions between 1-butyl-3-methylimidazolium tetrafluoroborate ionic liquid and 'gama'-'Al IND.2''O IND.3' (100) surface calculated by density functional theory. International Journal of Quantum Chemistry, v. 112, n. 19, p. 3234-3239, 2012Tradução . . Disponível em: https://doi.org/10.1002/qua.24162. Acesso em: 06 out. 2024.
APA
Martins, M. J. F., Ferreira, A. R., Konstantinova, E., Abreu, H. A. de, Souza, W. F., Chiaro, S. S. X., et al. (2012). Interactions between 1-butyl-3-methylimidazolium tetrafluoroborate ionic liquid and 'gama'-'Al IND.2''O IND.3' (100) surface calculated by density functional theory. International Journal of Quantum Chemistry, 112( 19), 3234-3239. doi:10.1002/qua.24162
NLM
Martins MJF, Ferreira AR, Konstantinova E, Abreu HA de, Souza WF, Chiaro SSX, Dias LG, Leitão AA. Interactions between 1-butyl-3-methylimidazolium tetrafluoroborate ionic liquid and 'gama'-'Al IND.2''O IND.3' (100) surface calculated by density functional theory [Internet]. International Journal of Quantum Chemistry. 2012 ; 112( 19): 3234-3239.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.24162
Vancouver
Martins MJF, Ferreira AR, Konstantinova E, Abreu HA de, Souza WF, Chiaro SSX, Dias LG, Leitão AA. Interactions between 1-butyl-3-methylimidazolium tetrafluoroborate ionic liquid and 'gama'-'Al IND.2''O IND.3' (100) surface calculated by density functional theory [Internet]. International Journal of Quantum Chemistry. 2012 ; 112( 19): 3234-3239.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.24162
Artigo de periodico
Crystal structure and theoretical calculations of Julocrotine, a natural product with antileishmanial activity (2008)
Moreira, Rafael Y. O.; Brasil, Davi S. B.; Alves, Claúdio N.; Guilhon, Gisele M. S. P.; Santos, Lourivaldo S.; Arruda, Mara S. P.; Müller, Adolfo H.; Barbosa, Patrícia S.; Abreu, Alcicley S.; Silva, Edilene O.; Rumjanek, Vicotr M.; Souza Junior, Jaime; Silva, Alberico Borges Ferreira da ; Santos, Regina Helena de Almeida
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
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ABNT
MOREIRA, Rafael Y. O. et al. Crystal structure and theoretical calculations of Julocrotine, a natural product with antileishmanial activity. International Journal of Quantum Chemistry, v. 108, n. 3, p. 513-520, 2008Tradução . . Disponível em: https://doi.org/10.1002/qua.21355. Acesso em: 06 out. 2024.
APA
Moreira, R. Y. O., Brasil, D. S. B., Alves, C. N., Guilhon, G. M. S. P., Santos, L. S., Arruda, M. S. P., et al. (2008). Crystal structure and theoretical calculations of Julocrotine, a natural product with antileishmanial activity. International Journal of Quantum Chemistry, 108( 3), 513-520. doi:10.1002/qua.21355
NLM
Moreira RYO, Brasil DSB, Alves CN, Guilhon GMSP, Santos LS, Arruda MSP, Müller AH, Barbosa PS, Abreu AS, Silva EO, Rumjanek VM, Souza Junior J, Silva ABF da, Santos RH de A. Crystal structure and theoretical calculations of Julocrotine, a natural product with antileishmanial activity [Internet]. International Journal of Quantum Chemistry. 2008 ; 108( 3): 513-520.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.21355
Vancouver
Moreira RYO, Brasil DSB, Alves CN, Guilhon GMSP, Santos LS, Arruda MSP, Müller AH, Barbosa PS, Abreu AS, Silva EO, Rumjanek VM, Souza Junior J, Silva ABF da, Santos RH de A. Crystal structure and theoretical calculations of Julocrotine, a natural product with antileishmanial activity [Internet]. International Journal of Quantum Chemistry. 2008 ; 108( 3): 513-520.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.21355
Artigo de periodico
Adapted relativistic prolapse-free gaussian basis sets for closed shell atoms up to nobelium and to be used with the uniform sphere nucleus model (2006)
Macedo, Luiz Guilherme Machado de; Haiduke, Roberto Luiz Andrade ; Comar Junior, Moacyr; Silva, Alberico Borges Ferreira da
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
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ABNT
MACEDO, Luiz Guilherme Machado de et al. Adapted relativistic prolapse-free gaussian basis sets for closed shell atoms up to nobelium and to be used with the uniform sphere nucleus model. International Journal of Quantum Chemistry, v. 106, n. 13, p. 2790-2803, 2006Tradução . . Disponível em: https://doi.org/10.1002/qua.21076. Acesso em: 06 out. 2024.
APA
Macedo, L. G. M. de, Haiduke, R. L. A., Comar Junior, M., & Silva, A. B. F. da. (2006). Adapted relativistic prolapse-free gaussian basis sets for closed shell atoms up to nobelium and to be used with the uniform sphere nucleus model. International Journal of Quantum Chemistry, 106( 13), 2790-2803. doi:10.1002/qua.21076
NLM
Macedo LGM de, Haiduke RLA, Comar Junior M, Silva ABF da. Adapted relativistic prolapse-free gaussian basis sets for closed shell atoms up to nobelium and to be used with the uniform sphere nucleus model [Internet]. International Journal of Quantum Chemistry. 2006 ; 106( 13): 2790-2803.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.21076
Vancouver
Macedo LGM de, Haiduke RLA, Comar Junior M, Silva ABF da. Adapted relativistic prolapse-free gaussian basis sets for closed shell atoms up to nobelium and to be used with the uniform sphere nucleus model [Internet]. International Journal of Quantum Chemistry. 2006 ; 106( 13): 2790-2803.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.21076
Artigo de periodico
Generator coordinate hartree-fock method applied to the choice of a contracted gaussian basis for the second-row atoms (1997)
Pinheiro, J. C.; Silva, Alberico Borges Ferreira da ; Trsic, M
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
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ABNT
PINHEIRO, J. C. e SILVA, Alberico Borges Ferreira da e TRSIC, M. Generator coordinate hartree-fock method applied to the choice of a contracted gaussian basis for the second-row atoms. International Journal of Quantum Chemistry, v. 63, n. 5 , p. 927-34, 1997Tradução . . Disponível em: https://doi.org/10.1002/(sici)1097-461x(1997)63:5%3C927::aid-qua3%3E3.0.co;2-y. Acesso em: 06 out. 2024.
APA
Pinheiro, J. C., Silva, A. B. F. da, & Trsic, M. (1997). Generator coordinate hartree-fock method applied to the choice of a contracted gaussian basis for the second-row atoms. International Journal of Quantum Chemistry, 63( 5 ), 927-34. doi:10.1002/(sici)1097-461x(1997)63:5%3C927::aid-qua3%3E3.0.co;2-y
NLM
Pinheiro JC, Silva ABF da, Trsic M. Generator coordinate hartree-fock method applied to the choice of a contracted gaussian basis for the second-row atoms [Internet]. International Journal of Quantum Chemistry. 1997 ;63( 5 ): 927-34.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/(sici)1097-461x(1997)63:5%3C927::aid-qua3%3E3.0.co;2-y
Vancouver
Pinheiro JC, Silva ABF da, Trsic M. Generator coordinate hartree-fock method applied to the choice of a contracted gaussian basis for the second-row atoms [Internet]. International Journal of Quantum Chemistry. 1997 ;63( 5 ): 927-34.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/(sici)1097-461x(1997)63:5%3C927::aid-qua3%3E3.0.co;2-y
Artigo de periodico
Ab initio calculations of relativistic and electron correlation effects in polyatomics using the universal gaussian basis set: 'XE''F IND.2' (1995)
Malli, G L; Styszynski, J; Silva, Alberico Borges Ferreira da
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
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ABNT
MALLI, G L e STYSZYNSKI, J e SILVA, Alberico Borges Ferreira da. Ab initio calculations of relativistic and electron correlation effects in polyatomics using the universal gaussian basis set: 'XE''F IND.2'. International Journal of Quantum Chemistry, v. 55, n. 3 , p. 213-25, 1995Tradução . . Disponível em: https://doi.org/10.1002/qua.560550302. Acesso em: 06 out. 2024.
APA
Malli, G. L., Styszynski, J., & Silva, A. B. F. da. (1995). Ab initio calculations of relativistic and electron correlation effects in polyatomics using the universal gaussian basis set: 'XE''F IND.2'. International Journal of Quantum Chemistry, 55( 3 ), 213-25. doi:10.1002/qua.560550302
NLM
Malli GL, Styszynski J, Silva ABF da. Ab initio calculations of relativistic and electron correlation effects in polyatomics using the universal gaussian basis set: 'XE''F IND.2' [Internet]. International Journal of Quantum Chemistry. 1995 ;55( 3 ): 213-25.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560550302
Vancouver
Malli GL, Styszynski J, Silva ABF da. Ab initio calculations of relativistic and electron correlation effects in polyatomics using the universal gaussian basis set: 'XE''F IND.2' [Internet]. International Journal of Quantum Chemistry. 1995 ;55( 3 ): 213-25.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560550302
Artigo de periodico
Considerations on gaussian expanded generator coordinate wave functions (1988)
Mohallem, J R; Trsic, M
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
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ABNT
MOHALLEM, J R e TRSIC, M. Considerations on gaussian expanded generator coordinate wave functions. International Journal of Quantum Chemistry, v. 33, p. 555-61, 1988Tradução . . Disponível em: https://doi.org/10.1002/qua.560330607. Acesso em: 06 out. 2024.
APA
Mohallem, J. R., & Trsic, M. (1988). Considerations on gaussian expanded generator coordinate wave functions. International Journal of Quantum Chemistry, 33, 555-61. doi:10.1002/qua.560330607
NLM
Mohallem JR, Trsic M. Considerations on gaussian expanded generator coordinate wave functions [Internet]. International Journal of Quantum Chemistry. 1988 ; 33 555-61.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560330607
Vancouver
Mohallem JR, Trsic M. Considerations on gaussian expanded generator coordinate wave functions [Internet]. International Journal of Quantum Chemistry. 1988 ; 33 555-61.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560330607
Artigo de periodico
Geometric approximation for molecular polarizabilities (1977)
Howat, G; Trsic, Milan; Goscinski, O
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
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ABNT
HOWAT, G e TRSIC, Milan e GOSCINSKI, O. Geometric approximation for molecular polarizabilities. International Journal of Quantum Chemistry, v. 11, p. 283-292, 1977Tradução . . Disponível em: https://doi.org/10.1002/qua.560110209. Acesso em: 06 out. 2024.
APA
Howat, G., Trsic, M., & Goscinski, O. (1977). Geometric approximation for molecular polarizabilities. International Journal of Quantum Chemistry, 11, 283-292. doi:10.1002/qua.560110209
NLM
Howat G, Trsic M, Goscinski O. Geometric approximation for molecular polarizabilities [Internet]. International Journal of Quantum Chemistry. 1977 ; 11 283-292.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560110209
Vancouver
Howat G, Trsic M, Goscinski O. Geometric approximation for molecular polarizabilities [Internet]. International Journal of Quantum Chemistry. 1977 ; 11 283-292.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560110209
Artigo de periodico
Differential scaling of 'delta' and 'pi' orbitals, and the geometric approximation for molecular polarizabilities (1977)
Howat, G; Trsic, Milan; Goscinski, O
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
HOWAT, G e TRSIC, Milan e GOSCINSKI, O. Differential scaling of 'delta' and 'pi' orbitals, and the geometric approximation for molecular polarizabilities. International Journal of Quantum Chemistry, v. 12, n. 5, p. 963-965, 1977Tradução . . Acesso em: 06 out. 2024.
APA
Howat, G., Trsic, M., & Goscinski, O. (1977). Differential scaling of 'delta' and 'pi' orbitals, and the geometric approximation for molecular polarizabilities. International Journal of Quantum Chemistry, 12( 5), 963-965.
NLM
Howat G, Trsic M, Goscinski O. Differential scaling of 'delta' and 'pi' orbitals, and the geometric approximation for molecular polarizabilities. International Journal of Quantum Chemistry. 1977 ; 12( 5): 963-965.[citado 2024 out. 06 ]
Vancouver
Howat G, Trsic M, Goscinski O. Differential scaling of 'delta' and 'pi' orbitals, and the geometric approximation for molecular polarizabilities. International Journal of Quantum Chemistry. 1977 ; 12( 5): 963-965.[citado 2024 out. 06 ]
Artigo de periodico
Singlet and triplet excited state electric dipole polarizabilities of conjugated hydrocarbons (1976)
Trsic, Milan; Sanhueza, J E; Espinoza, L
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
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ABNT
TRSIC, Milan e SANHUEZA, J E e ESPINOZA, L. Singlet and triplet excited state electric dipole polarizabilities of conjugated hydrocarbons. International Journal of Quantum Chemistry, v. 10, p. 429-437, 1976Tradução . . Disponível em: https://doi.org/10.1002/qua.560100306. Acesso em: 06 out. 2024.
APA
Trsic, M., Sanhueza, J. E., & Espinoza, L. (1976). Singlet and triplet excited state electric dipole polarizabilities of conjugated hydrocarbons. International Journal of Quantum Chemistry, 10, 429-437. doi:10.1002/qua.560100306
NLM
Trsic M, Sanhueza JE, Espinoza L. Singlet and triplet excited state electric dipole polarizabilities of conjugated hydrocarbons [Internet]. International Journal of Quantum Chemistry. 1976 ; 10 429-437.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560100306
Vancouver
Trsic M, Sanhueza JE, Espinoza L. Singlet and triplet excited state electric dipole polarizabilities of conjugated hydrocarbons [Internet]. International Journal of Quantum Chemistry. 1976 ; 10 429-437.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560100306
Artigo de periodico
Comparison of several expansions in the calculation of static electric dipole 'PI' polarizability of conjugated molecules by pertubation theory: the ground and the first excited singlet states (1972)
Matzke, P; Chacon, O; Sanhueza, E; Trsic, Milan
Source: International Journal of Quantum Chemistry. Unidade: IQSC
Assunto: QUÍMICA
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ABNT
MATZKE, P et al. Comparison of several expansions in the calculation of static electric dipole 'PI' polarizability of conjugated molecules by pertubation theory: the ground and the first excited singlet states. International Journal of Quantum Chemistry, v. 6, p. 407-412, 1972Tradução . . Disponível em: https://doi.org/10.1002/qua.560060303. Acesso em: 06 out. 2024.
APA
Matzke, P., Chacon, O., Sanhueza, E., & Trsic, M. (1972). Comparison of several expansions in the calculation of static electric dipole 'PI' polarizability of conjugated molecules by pertubation theory: the ground and the first excited singlet states. International Journal of Quantum Chemistry, 6, 407-412. doi:10.1002/qua.560060303
NLM
Matzke P, Chacon O, Sanhueza E, Trsic M. Comparison of several expansions in the calculation of static electric dipole 'PI' polarizability of conjugated molecules by pertubation theory: the ground and the first excited singlet states [Internet]. International Journal of Quantum Chemistry. 1972 ; 6 407-412.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560060303
Vancouver
Matzke P, Chacon O, Sanhueza E, Trsic M. Comparison of several expansions in the calculation of static electric dipole 'PI' polarizability of conjugated molecules by pertubation theory: the ground and the first excited singlet states [Internet]. International Journal of Quantum Chemistry. 1972 ; 6 407-412.[citado 2024 out. 06 ] Available from: https://doi.org/10.1002/qua.560060303

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