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Works matching IS 00207608 AND DT 2001 AND VI 83 AND IP 6

Results: 6

1

Theoretical study of the internal rotational barriers in nitrobenzene, 2-nitrotoluene, 2-nitrophenol, and 2-nitroaniline.

Published in:

International Journal of Quantum Chemistry, 2001, v. 83, n. 6, p. 332, doi. 10.1002/qua.1069

By:

Chen, P. C.;
Chen, S. C.

Publication type:

Article

2

Occupation numbers for atomic shells in direct space bounded by the maxima of the one-electron potential.

Published in:

International Journal of Quantum Chemistry, 2001, v. 83, n. 6, p. 324, doi. 10.1002/qua.1071

By:

Kohout, M.

Publication type:

Article

3

Rules on pair electron correlation in MOH (M=H, Li, Na).

Published in:

International Journal of Quantum Chemistry, 2001, v. 83, n. 6, p. 311, doi. 10.1002/qua.1064

By:

Zhuo, Shuping;
Wei, Jichong;
Shen, Changsheng;
Ju, Guanzhi

Publication type:

Article

4

Using theozymes for designing transition-state analogs for the intramolecular aldol reaction of δ-diketones.

Published in:

International Journal of Quantum Chemistry, 2001, v. 83, n. 6, p. 338, doi. 10.1002/qua.1070

By:

Arnó, Manuel;
Domingo, Luis R.

Publication type:

Article

5

Book review.

Published in:

International Journal of Quantum Chemistry, 2001, v. 83, n. 6, p. 348, doi. 10.1002/qua.1012

By:

Linderberg, Jan

Publication type:

Article

6

Density functional study of the relative reactivity in the concerted 1,3-dipolar cycloaddition of nitrile ylide to disubstituted ethylenes.

Published in:

International Journal of Quantum Chemistry, 2001, v. 83, n. 6, p. 318, doi. 10.1002/qua.1062

By:

Liao, Hsin‐Yi;
Su, Ming‐Der;
Chung, Wen‐Sheng;
Chu, San‐Yan

Publication type:

Article