Cabral, Benedito J.C.: search on Z-Library

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1

First-principles molecular dynamics of liquid cesium and rubidium

Cabral, Benedito José Costa, Martins, José Luís

Journal:

Physical Review B

Year:

1995

Language:

english

File:

PDF, 256 KB

english, 1995

2

On the spectral line width broadening for simulation of the two-photon absorption cross-section of para-Nitroaniline in liquid environment

Ramos, Tárcius N., Silva, Daniel L., Cabral, Benedito J.C., Canuto, Sylvio

Journal:

Journal of Molecular Liquids

Year:

2020

File:

PDF, 1.49 MB

2020

3

Options for Generation of Sustainable Energy: Production of Pellets Based on Combinations Between Lignocellulosic Biomasses

Scatolino, Mário Vanoli, Neto, Lázaro Ferreira Cabral, Protásio, Thiago de Paula, Carneiro, Angélica de Cássia Oliveira, Andrade, Carlos Rogério, Guimarães Júnior, José Benedito, Mendes, Lourival Mari

Journal:

Waste and Biomass Valorization

Year:

2017

Language:

english

File:

PDF, 1.50 MB

english, 2017

4

Lipid peroxidation, chloroplastic pigments and antioxidant strategies inCarapa guianensis(Aubl.) subjected to water-deficit and short-term rewetting

Marcelle Auday Costa, Hugo Alves Pinheiro, Elizabeth Santos Cordeiro Shimizu, Felipe Tameirão Fonseca, Benedito Gomes dos Santos Filho, Fabrícia Kelly Cabral Moraes, Diego Moreira de Figueiredo

Journal:

Year:

2010

Language:

english

File:

PDF, 353 KB

english, 2010

5

Ionization of chlorophyll-c2 in liquid methanol

Jaramillo, Paula, Coutinho, Kaline, Cabral, Benedito J. Costa, Canuto, Sylvio

Journal:

Chemical Physics Letters

Year:

2012

Language:

english

File:

PDF, 971 KB

english, 2012

6

Anthropometric Measurements in Toothed and Toothless Maxillaries and its Consequences in Human Alveolar Bone Resorption

de Oliveira, Jaciel Benedito, Almeida, Andrelle Nayara Cavalcanti Lima de, Lins, Carla Cabral dos Santos Accioly, Júnior, Adelmar Afonso de Amorim, Seixas, Zélia Albuquerque

Journal:

International Journal of Morphology

Year:

2012

File:

PDF, 302 KB

2012

7

New cadinene-sesquiterpene from Chromolaena laevigata (lam.) R. M. King & H. Rob (Asteraceae) aerial parts and biological activities

de Oliveira, Josiane A. Monteiro, Bernardi, Darlon Irineu, Balbinot, Rodolfo Bento, Cabral, MÃ¡rcia Regina Pereira, Zanqueta, Ãrica Benassi, Endo, Eliana H., Dias Filho, Benedito Prado, Nakamura, Tan

Journal:

Natural Product Research

Year:

2020

File:

PDF, 2.15 MB

2020

8

Energetics of C−Cl, C−Br, and C−I Bonds in Haloacetic Acids: Enthalpies of Formation of XCH2COOH (X=Cl, Br, I) Compounds and the Carboxymethyl Radical

Ana L. C. Lagoa, Hermínio P. Diogo, M. Pilar Dias, Manuel E. Minas da Piedade, Luísa M. P. F. Amaral, Manuel A. V. Ribeiro da Silva, José A. Martinho Simões, Rita C. Guedes, Benedito J. Costa Cabral,

Journal:

Chemistry - A European Journal

Year:

2001

Language:

english

File:

PDF, 233 KB

english, 2001

9

Energetics of the Allyl Group.

Agapito, Filipe, Nunes, Paulo M., Cabral, Benedito J. Costa, Borges dos Santos, Rui M., Simões, José A. Martinho

Journal:

Journal of Organic Chemistry

Year:

2008

Language:

english

File:

PDF, 21 KB

english, 2008

10

Introduction

Kaline Coutinho, Benedito J. Costa Cabral, Rogério Custodio

Journal:

International Journal of Quantum Chemistry

Year:

2011

Language:

english

File:

PDF, 72 KB

english, 2011

11

Substituent effects on the O-H bond dissociation enthalpies in phenolic compounds: agreements and controversies

Bizarro, Magda M., Cabral, Benedito J. Coota, de Santos, Rui M. Borges, Martinho Simões, José A.

Journal:

Pure & Applied Chemistry

Year:

1999

Language:

english

File:

PDF, 205 KB

english, 1999

12

Liquid water structure from X-ray absorption and emission, NMR shielding and X-ray diffraction

Zhovtobriukh, Iurii, Cabral, Benedito J. C., Corsaro, Carmelo, Mallamace, Domenico, Pettersson, Lars G. M.

Journal:

SCIENCE CHINA Physics, Mechanics & Astronomy

Year:

2019

Language:

english

File:

PDF, 830 KB

english, 2019

13

Reaction of para-Hydroxy-Substituted Diphenylmethanes with tert-Butoxy Radical

Catarina F. Correia, Rui M. Borges dos Santos, Sílvia G. Estácio, João P. Telo, Benedito J. Costa Cabral, José A. Martinho Simões

Journal:

Year:

2004

Language:

english

File:

PDF, 105 KB

english, 2004

14

Estabilidade dimensional e resistência à tração perpendicular de painéis fabricados com partículas termorretificadas oriundas de embalagens de Pinus sp.

Vital, Benedito Rocha, Andrade, Paulo Ivan Lima, Carneiro, Angélica de Cássia Oliveira, Cabral, Carla Priscilla Távora, Carvalho, Ana Márcia Macêdo

Journal:

Revista Árvore

Year:

2014

File:

PDF, 226 KB

2014

15

Electronic properties of a methane–water solution

Margarida P.S. Mateus, Nuno Galamba, Benedito J. Costa Cabral, Kaline Coutinho, Sylvio Canuto

Journal:

Chemical Physics Letters

Year:

2011

Language:

english

File:

PDF, 606 KB

english, 2011

16

Structure and electronic properties of a strong dipolar liquid: Born–Oppenheimer molecular dynamics of liquid hydrogen cyanide

Martiniano, Hugo F.M.C., Costa Cabral, Benedito J.

Journal:

Chemical Physics Letters

Year:

2013

Language:

english

File:

PDF, 478 KB

english, 2013

17

Filipin Orientation Revealed by Linear Dichroism. Implication for a Model of Action

Lopes, Sílvia C. D. N., Goormaghtigh, Erik, Costa Cabral, Benedito J., Castanho, Miguel A. R. B.

Journal:

Journal of the American Chemical Society

Year:

2004

Language:

english

File:

PDF, 165 KB

english, 2004

18

Energetics of tert -Butoxyl Addition Reaction to Norbornadiene: A Method for Estimating the π-Bond Strength of a Carbon−Carbon Double Bond

Nunes, Paulo M., Estácio, Sílvia G., Lopes, Gustavo T., Agapito, Filipe, Santos, Rui C., Costa Cabral, Benedito J., Borges dos Santos, Rui M., Martinho Simões, José A.

Journal:

Journal of Physical Chemistry A

Year:

2009

Language:

english

File:

PDF, 272 KB

english, 2009

19

Energetics of the C−Cl Bond in CH 3 CH(Cl)COOH. Enthalpy of Formation of ( S )-(−)-2-Chloropropionic Acid and of the 1-Carboxyethyl Radical †,‡

Lagoa, Ana L. C., Diogo, Hermínio P., Minas da Piedade, Manuel E., Amaral, Luísa M. P. F., Guedes, Rita C., Costa Cabral, Benedito J., Kulikov, Dmitry V., Verevkin, Sergey P., Siedler, Michael, Epple,

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 106 KB

english, 2002

20

Estabilidade dimensional e resistência à tração perpendicular de painéis fabricados com partículas termorretificadas oriundas de embalagens de Pinus sp.

Vital, Benedito Rocha, Andrade, Paulo Ivan Lima, Carneiro, Angélica de Cássia Oliveira, Cabral, Carla Priscilla Távora, Carvalho, Ana Márcia Macêdo

Journal:

Revista Árvore

Year:

2014

File:

PDF, 226 KB

2014

21

Explicit solvent effects on the visible absorption spectrum of a photosynthetic pigment: Chlorophyll-c2 in methanol

Paula Jaramillo, Kaline Coutinho, Benedito J.C. Cabral, Sylvio Canuto

Journal:

Chemical Physics Letters

Year:

2011

Language:

english

File:

PDF, 638 KB

english, 2011

22

ROME.

Martiniano, Hugo F.M.C., Costa Cabral, Benedito J.

Journal:

Year:

1899

Language:

english

File:

PDF, 423 KB

english, 1899

23

ChemInform Abstract: Substituent Effects on the O—H Bond Dissociation Enthalpies in Phenolic Compounds: Agreements and Controversies

Magda M. Bizarro, Benedito J. Costa Cabral, Rui M. Borges Dos Santos, Jose A. Martinho Simoes

Journal:

Year:

2000

File:

PDF, 26 KB

2000

24

Structure and electronic properties of a benzene-water solution

Mateus, Margarida P. S., Galamba, Nuno, Cabral, Benedito J. Costa

Journal:

The Journal of Chemical Physics

Year:

2012

Language:

english

File:

PDF, 1.28 MB

english, 2012

25

Energetic Differences between the Five- and Six-Membered Ring Hydrocarbons: Strain Energies in the Parent and Radical Molecules

Agapito, Filipe, Nunes, Paulo M., Costa Cabral, Benedito J., Borges dos Santos, Rui M., Martinho Simões, José A.

Journal:

Journal of Organic Chemistry

Year:

2008

Language:

english

File:

PDF, 297 KB

english, 2008

26

15N NMR Shifts of Eumelanin Building Blocks in Water: A Combined Quantum Mechanics/Statistical Mechanics Approach

Assis Oliveira, Leonardo Bruno, L. Fonseca, Tertius, Cabral, Benedito J. C.

Journal:

Year:

2020

File:

PDF, 2.05 MB

2020

27

Study of doubly charged alkaline earth metal and 3-azidopropionitrile complexes by electrospray ionization mass spectrometry

Narciso Couto, M. João Ramos, M. Tereza Fernandez, Paula Rodrigues, M. Teresa Barros, M. Lourdes Costa, Benedito J. Costa Cabral, M. Filomena Duarte

Journal:

Rapid Communications in Mass Spectrometry

Year:

2008

Language:

english

File:

PDF, 184 KB

english, 2008

28

Structure and conformational equilibrium of thiacalix[4]arene by density functional theory

Raul J. Bernardino, Benedito J. Costa Cabral

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2001

Language:

english

File:

PDF, 167 KB

english, 2001

29

Enthalpy of Formation of the Cyclopentadienyl Radical: Photoacoustic Calorimetry and ab Initio Studies

Nunes, Paulo M., Agapito, Filipe, Costa Cabral, Benedito J., Borges dos Santos, Rui M., Martinho Simões, José A.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 59 KB

english, 2006

30

Hydrogen bonding and the dipole moment of hydrofluorocarbons by density functional theory

Costa Cabral, Benedito J., Guedes, Rita C., Pai-Panandiker, Rahool S., Nieto de Castro, Carlos A.

Journal:

Physical Chemistry Chemical Physics

Year:

2001

Language:

english

File:

PDF, 250 KB

english, 2001

31

Ab initio calculation of the electronic absorption spectrum of liquid water

Martiniano, Hugo F. M. C., Galamba, Nuno, Cabral, Benedito J. Costa

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.08 MB

english, 2014

32

Probing Lewis Acid–Base Interactions with Born–Oppenheimer Molecular Dynamics: The Electronic Absorption Spectrum of p -Nitroaniline in Supercritical CO 2

Cabral, Benedito J. Costa, Rivelino, Roberto, Coutinho, Kaline, Canuto, Sylvio

Journal:

Journal of Physical Chemistry B

Year:

2015

Language:

english

File:

PDF, 1.39 MB

english, 2015

33

Electron binding energies and the fundamental gap of a push-pull dye in a polar environment: p-nitroaniline in liquid water

Cabral, Benedito J.C.

Journal:

Chemical Physics Letters

Year:

2016

Language:

english

File:

PDF, 1.71 MB

english, 2016

34

Oxygen–oxygen bond dissociation enthalpies of di-tert-butyl peroxide and di-trifluoromethyl peroxide

Filipe Agapito, Benedito J. Costa Cabral, José A. Martinho Simões

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2005

Language:

english

File:

PDF, 176 KB

english, 2005

35

Propriedades de chapas de aglomerado confeccionadas com misturas de partículas de Eucalyptus spp e Pinus elliottii

Cabral, Carla Priscilla, Vital, Benedito Rocha, Lucia, Ricardo Marius Della, Pimenta, Alexandre Santos

Journal:

Revista Árvore

Year:

2007

File:

PDF, 250 KB

2007

36

Density-functional and density-functional reaction field calculations of the molecular properties of phenol

Benedito José Costa Cabral, RenéGil Bakker Fonseca, JoséArtur Martinho Simões

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 535 KB

english, 1996

37

S–H bond dissociation enthalpies: The importance of a complete basis set approach

P. Cabral do Couto, Benedito J. Costa Cabral, José A. Martinho Simões

Journal:

Chemical Physics Letters

Year:

2006

Language:

english

File:

PDF, 106 KB

english, 2006

38

Electronic excitation and ionization of hydrogen peroxide–water clusters: Comparison with water clusters

Cristiane Ferreira, Hugo F. M. C. Martiniano, Benedito J. Costa Cabral, Vincenzo Aquilanti

Journal:

International Journal of Quantum Chemistry

Year:

2011

Language:

english

File:

PDF, 586 KB

english, 2011

39

Quadrupole Polarization in Simulations of Ionic Systems: Application to AgCl

Wilson, Mark, Madden, Paul A., Costa-Cabral, Benedito J.

Journal:

Journal of Physical Chemistry

Year:

1996

Language:

english

File:

PDF, 616 KB

english, 1996

40

First principles molecular dynamics simulation of liquid rubidium

Benedito José Costa Cabral, José Luís Martins

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1995

Language:

english

File:

PDF, 380 KB

english, 1995

41

Electronic Excitation of Cl − in Liquid Water and at the Surface of a Cluster: A Sequential Born−Oppenheimer Molecular Dynamics/Quantum Mechanics Approach †

Galamba, Nuno, Mata, Ricardo A., Cabral, Benedito J. Costa

Journal:

Journal of Physical Chemistry A

Year:

2009

Language:

english

File:

PDF, 1.61 MB

english, 2009

42

Hydration effects on the electronic properties of eumelanin building blocks

Assis Oliveira, Leonardo Bruno, L. Fonseca, Tertius, Costa Cabral, Benedito J., Coutinho, Kaline, Canuto, Sylvio

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 5.78 MB

english, 2016

43

ANATOMICAL AND CHEMICAL PROPERTIES OF JUVENILE Schizolobium amazonicum WOOD

Vidaurre, Graziela Baptista, Vital, Benedito Rocha, Colodette, Jorge Luiz, Oliveira, Angélica de Cássia, Silva, João Gabriel Missia da, Moulin, Jordão Cabral, Soranso, Denise Ransolin

Journal:

Revista Árvore

Year:

2018

File:

PDF, 1.82 MB

2018

44

Electron binding energies of organic azides: Green’s function and density functional theory versus Hartree–Fock calculations

Margarida P.S. Mateus, Benedito J.C. Cabral

Journal:

Chemical Physics Letters

Year:

2007

Language:

english

File:

PDF, 409 KB

english, 2007

45

Structure and electronic properties of hydrated mesityl oxide: a sequential quantum mechanics/molecular mechanics approach

Marcus V. A. Damasceno, Benedito J. Costa Cabral, Kaline Coutinho

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2012

Language:

english

File:

PDF, 585 KB

english, 2012

46

Experimental and theoretical proton affinity of limonene

Tereza Fernandez, M., Williams, Chris, Mason, Rod S., Costa Cabral, Benedito J.

Journal:

Journal of the Chemical Society Faraday Transactions

Year:

1998

Language:

english

File:

PDF, 134 KB

english, 1998

47

A First-Principles Approach to the Dynamics and Electronic Properties of p -Nitroaniline in Water

Cabral, Benedito J. Costa, Coutinho, Kaline, Canuto, Sylvio

Journal:

Journal of Physical Chemistry A

Year:

2016

Language:

english

File:

PDF, 2.50 MB

english, 2016

48

Dipole polarizability and Rayleigh light scattering by the hydrated electron

Tertius L. Fonseca, Marcos A. Castro, Benedito J.C. Cabral, Kaline Coutinho, Sylvio Canuto

Journal:

Chemical Physics Letters

Year:

2009

Language:

english

File:

PDF, 333 KB

english, 2009

49

Energetics of Hydroxybenzoic Acids and of the Corresponding Carboxyphenoxyl Radicals. Intramolecular Hydrogen Bonding in 2-Hydroxybenzoic Acid

Pinto, Susana S., Diogo, Hermínio P., Guedes, Rita C., Costa Cabral, Benedito J., Minas da Piedade, Manuel E., Martinho Simões, José A.

Journal:

Journal of Physical Chemistry A

Year:

2005

Language:

english

File:

PDF, 299 KB

english, 2005

50

Dynamic polarizability, Cauchy moments, and the optical absorption spectrum of liquid water: A sequential molecular dynamics/quantum mechanical approach

Mata, Ricardo A., Cabral, Benedito J. Costa, Millot, Claude, Coutinho, Kaline, Canuto, Sylvio

Journal:

The Journal of Chemical Physics

Year:

2009

Language:

english

File:

PDF, 629 KB

english, 2009

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