Works matching IS 01928651 AND DT 2015 AND VI 36 AND IP 3
Results: 9
Cover Image, Volume 36, Issue 3.
- Published in:
- 2015
- Publication type:
- Other
Linear-scaling self-consistent field calculations based on divide-and-conquer method using resolution-of-identity approximation on graphical processing units.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 3, p. 164, doi. 10.1002/jcc.23782
- By:
- Publication type:
- Article
Nature of the water/aromatic parallel alignment interactions.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 3, p. 171, doi. 10.1002/jcc.23783
- By:
- Publication type:
- Article
Symmetry calculation for molecules and transition states.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 3, p. 181, doi. 10.1002/jcc.23788
- By:
- Publication type:
- Article
Semiempirical and DFT computations of the influence of Tb(III) dopant on unit cell dimensions of cerium(III) fluoride.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 3, p. 193, doi. 10.1002/jcc.23789
- By:
- Publication type:
- Article
Cover Image, Volume 36, Issue 3.
- Published in:
- 2015
- Publication type:
- Other
Isolated pentagon rule violating endohedral metallofullerenes explained using the Hückel rule: A statistical mechanical study of the C<sub>84</sub> Isomeric Set.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 3, p. 146, doi. 10.1002/jcc.23774
- By:
- Publication type:
- Article
Theoretical analysis of excited states and energy transfer mechanism in conjugated dendrimers.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 3, p. 151, doi. 10.1002/jcc.23778
- By:
- Publication type:
- Article
Clarifying and illustrating the electronic energy transfer pathways in trimeric and hexameric aggregation state of cyanobacteria allophycocyanin within the framework of Förster theory.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 3, p. 137, doi. 10.1002/jcc.23770
- By:
- Publication type:
- Article