Works matching IS 00207608 AND DT 2005 AND VI 103 AND IP 4

Results: 8

Theoretical evaluation of the nanocarrier properties of two families of functionalized dendrimers.

Published in:

International Journal of Quantum Chemistry, 2005, v. 103, n. 4, p. 460, doi. 10.1002/qua.20517

By:

Evangelista‐Lara, Aurelio;
Guadarrama, Patricia

Publication type:

Article

Theoretical studies of growth mechanism of small fullerene cage C24 (D6d)+.

Published in:

International Journal of Quantum Chemistry, 2005, v. 103, n. 4, p. 355, doi. 10.1002/qua.20476

By:

Lin, Wen‐Hsin;
Tu, Chih‐Chiang;
Lee, Shyi‐Long

Publication type:

Article

DFT investigation of sites of protonation of antitumor of 2-(4-aminophenyl)benzazoles in the gas phase and in solution.

Published in:

International Journal of Quantum Chemistry, 2005, v. 103, n. 4, p. 449, doi. 10.1002/qua.20500

By:

Hilal, Rifaat;
Elroby, Shabaan A. K.

Publication type:

Article

Theoretical study of laser light generation and color image formation: FA1:Cs+ and FA2:Li+ centers at the low coordination (100) and (110) surfaces of AgCl and AgBr.

Published in:

International Journal of Quantum Chemistry, 2005, v. 103, n. 4, p. 432, doi. 10.1002/qua.20515

By:

Shalabi, A. S.;
Kamel, M. A.;
Ammar, H. Y.

Publication type:

Article

Effects of thermal modulation on tunneling through a fluctuating barrier in presence of bichromatic electromagnetic field.

Published in:

International Journal of Quantum Chemistry, 2005, v. 103, n. 4, p. 388, doi. 10.1002/qua.20516

By:

Saha, Aparna;
Sarkar, Pranab

Publication type:

Article

Scaling factors for the prediction of vibrational spectra. II. The aniline molecule and several derivatives.

Published in:

International Journal of Quantum Chemistry, 2005, v. 103, n. 4, p. 394, doi. 10.1002/qua.20416

By:

Palafox, M. Alcolea;
Gill, M.;
Nunez, N. J.;
Rastogi, V. K.;
Mittal, Lalit;
Sharma, Rekha

Publication type:

Article

Triplet potential energy surface for BH2N: A DFT study.

Published in:

International Journal of Quantum Chemistry, 2005, v. 103, n. 4, p. 422, doi. 10.1002/qua.20531

By:

Zhang, Jian‐Guo;
Li, Qian Shu;
Zhang, Shao‐Wen

Publication type:

Article

Two-dimensional hydrogen atom confined in circles, angles, and circular sectors.

Published in:

International Journal of Quantum Chemistry, 2005, v. 103, n. 4, p. 369, doi. 10.1002/qua.20540

By:

Chaos‐Cador, L.;
Ley‐Koo, E.

Publication type:

Article

Works matching IS 00207608 AND DT 2005 AND VI 103 AND IP 4

Theoretical evaluation of the nanocarrier properties of two families of functionalized dendrimers.

Theoretical studies of growth mechanism of small fullerene cage C<sub>24</sub> (D<sub>6d</sub>)<sup>+</sup>.

DFT investigation of sites of protonation of antitumor of 2-(4-aminophenyl)benzazoles in the gas phase and in solution.

Theoretical study of laser light generation and color image formation: F<sub>A1</sub>:Cs<sup>+</sup> and F<sub>A2</sub>:Li<sup>+</sup> centers at the low coordination (100) and (110) surfaces of AgCl and AgBr.

Effects of thermal modulation on tunneling through a fluctuating barrier in presence of bichromatic electromagnetic field.

Scaling factors for the prediction of vibrational spectra. II. The aniline molecule and several derivatives.

Triplet potential energy surface for BH<sub>2</sub>N: A DFT study.

Two-dimensional hydrogen atom confined in circles, angles, and circular sectors.