Dedication.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 257, doi. 10.1002/jcc.540070302
- Publication type:
- Article
Works matching IS 01928651 AND DT 1986 AND VI 7 AND IP 3
Results: 16
1
2
Molecular orbital theory of the properties of inorganic and organometallic compounds 4. Extended basis sets for third-and fourth-row, main-group elements.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 359, doi. 10.1002/jcc.540070313
- By:
- Publication type:
- Article
3
Reactions involving CO<sub>2</sub>, H<sub>2</sub>O, and NH<sub>3</sub>: The formation of (i) carbamic acid, (ii) urea, and (iii) carbonic acid.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 283, doi. 10.1002/jcc.540070306
- By:
- Publication type:
- Article
4
Masthead.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. fmi, doi. 10.1002/jcc.540070301
- Publication type:
- Article
5
The evaluation of molecular electron affinities.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 349, doi. 10.1002/jcc.540070312
- By:
- Publication type:
- Article
6
An unconventional scf method for calculations on large molecules.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 274, doi. 10.1002/jcc.540070305
- By:
- Publication type:
- Article
7
Archives, bibliographies, and data bases: How to search the ab initio Quantum Chemistry Literature.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 380, doi. 10.1002/jcc.540070316
- By:
- Publication type:
- Article
8
Ab initio determination of the proton affinities of small neutral and anionic molecules.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 321, doi. 10.1002/jcc.540070309
- By:
- Publication type:
- Article
9
Conformational stability and flexibility of the ala dipeptide in free space and water: Monte Carlo computer simulation studies.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 345, doi. 10.1002/jcc.540070311
- By:
- Publication type:
- Article
10
Gas-phase nitrosation of benzene: Theoretical investigations.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 265, doi. 10.1002/jcc.540070304
- By:
- Publication type:
- Article
11
A handbook of computational chemistry: A practical guide to chemical structure and energy calculations, by Tim Clark, John Wiley, New York, 332 pp. Price: $35.00 (1985).
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 379, doi. 10.1002/jcc.540070315
- By:
- Publication type:
- Article
12
Ab initio studies of H<sub>2</sub>PXYH molecules (X, Y = O, S).
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 306, doi. 10.1002/jcc.540070308
- By:
- Publication type:
- Article
13
The remarkably invariant interaction energies of lithium first-row compounds with water and with ammonia.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 334, doi. 10.1002/jcc.540070310
- By:
- Publication type:
- Article
14
Basis set and correlation effects on computed lithium ion affinities of some oxygen and nitrogen bases.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 259, doi. 10.1002/jcc.540070303
- By:
- Publication type:
- Article
15
Ab Initio Molecular Orbital Theory by W. J. Hehre, L. Radom, P. v. R. Schleyer, and J. A. Pople, John Wiley, New York, 548pp. Price: $79.95 (1986).
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 379, doi. 10.1002/jcc.540070314
- By:
- Publication type:
- Article
16
Theoretical studies of O<sub>2</sub><sup>−</sup>:(H<sub>2</sub>O)<sub> n</sub> clusters.
- Published in:
- Journal of Computational Chemistry, 1986, v. 7, n. 3, p. 294, doi. 10.1002/jcc.540070307
- By:
- Publication type:
- Article