Rational curves of degree at most 9 on a general quintic threefold

ABSTRACT.

We prove the following form of the Clemens conjecture in low degree. Let d ≤ 9, and let F be a general quintic threefold in P ⁴. Then (1) the Hilbert scheme of rational, smooth and irreducible curves of degree d on F is finite, nonempty, and reduced; moreover, each curve is embedded in F with normal bundle (?1) ⊕ (?1), and in P ⁴ with maximal rank. (2) On F, there are no rational, singular, reduced and irreducible curves of degree d, except for the 17,601,000 six-nodal plane quintics (found by Vainsencher). (3) On F, there are no connected, reduced and reducible curves of degree d with rational components.     

Density-functional theory calculation of the nuclear magnetic resonance indirect nuclear spin—spin coupling constants in C60

Density-functional theory is used to study the nuclear magnetic resonance (NMR) indirect nuclear spin-spin coupling constants in C₆₀. Knowledge of these coupling constants may help in the analysis of future experimental NMR studies of ¹³C-enriched C₆₀. At the Becke 3-parameter Lee-Yang-Parr (B3LYP) Kohn-Sham level, the one-bond couplings within pentagons and between pentagons are 62 Hz and 77 Hz, respectively; the corresponding geminal couplings are 7 Hz and 1 Hz, respectively. Except for the vicinal couplings (about 4 Hz), the long-range couplings are all 1 Hz or smaller. This is the largest theoretical calculation to date of the complete set of indirect nuclear spin-spin coupling constants of a molecular system; it has been made possible by solving the response equations only for the perturbing operators related to one nuclear magnetic moment, making the calculation feasible.     

ChemInform Abstract: The Ground-State Potential Energy Surface of Diazene

has been studied by using a complete active space MCSCF wave function generated by distributing eight electrons among eight orbitals.