Engineering topics

Resing, H. A.

Publications and source records attributed to Resing, H. A..

6 records

NASA NTRS1987

Indirect measurement of N-14 quadrupolar coupling for NH3 intercalated in potassium graphite

A method for indirect measurement of the nuclear quadrupolar coupling was developed and applied to NH3 molecules in the graphite intercalation compound K(NH3)4.3C24, which has a layered structure with alternating carbon and intercalant layers. Three triplets were observed in the H-1 NMR spectra of the compound. The value of the N-14 quadrupolar coupling constant of NH3 (3.7 MHz), determined indirectly from the H-1 NMR spectra, was intermediate between the gas value of 4.1 MHz and the solid-state value of 3.2 MHz. The method was also used to deduce the (H-1)-(H-1) and (N-14)-(H-1) dipolar interactions, the H-1 chemical shifts, and the molecular orientations and motions of NH3.

Tsang, T.↗

NASA NTRS1987

C-13 N.M.R. study of charge transfer in alkali metal-ammonia graphite compounds

The usefulness of C-13 NMR spectroscopy and chemical shift for the study of charge transfer in graphite intercalation compounds is demonstrated. A linear relationship is established between the chemical shifts and the square root of the absolute value of the electronic charge per carbon atom. The method is applied to the ternary alkali metal-ammonia-graphite compounds. Weak solvations of electronic charges by ammonia are observed.

Tsang, T.↗

NASA NTRS1987

H-1 NMR study of ternary ammonia-alkali metal-graphite intercalation compounds

For the first-stage ternary ammonia-alkali metal-graphite intercalation compounds M(NH3)(x)C24(x of about 4, M = K, Rb, Cs), three sets of triplet H-1 NMR spectral lines have been observed at various temperatures and orientations due to the H-1 - H-1 and N-14 - H-1 dipolar interactions. The structures of these compounds have been inferred as mobile (liquid-like) intercalant layers of planar M(NH3)4 ions in between the carbon layers. For the intercalated ammonia molecules, the potential barrier is about 0.2 eV and the molecular geometry is very close to the free NH3 in gas phase.

Tsang, T.↗

NASA NTRS1985

The 13C nuclear magnetic resonance in graphite intercalation compounds

The (13)C NMR chemical shifts of graphite intercalation compounds were calculated. For acceptor types, the shifts come mainly from the paramagnetic (Ramsey) intra-atomic terms. They are related to the gross features of the two-dimensional band structures. The calculated anisotropy is about -140 ppm and is independent of the finer details such as charge transfer. For donor types, the carbon 2p pi orbitals are spin-polarized because of mixing with metal conduction electrons, thus there is an additional dipolar contribution which may be correlated with the electronic specific heat. The general agreement with experimental data is satisfactory.

Tsang, T.↗

NASA NTRS1985

C-13 nuclear magnetic resonance in graphite intercalation compounds

The C-13 NMR chemical shifts of graphite intercalation compounds have been calculated. For acceptor types, the shifts come mainly from the paramagnetic (Ramsey) intra-atomic terms. They are related to the gross features of the two-dimensional band structures. The calculated anisotropy is about - 140 ppm and is independent of the finer details such as charge transfer. For donor types, the carbon 2p pi orbitals are spin-polarized because of mixing with metal-conduction electrons, thus there is an additional dipolar contribution which may be correlated with the electronic specific heat. The general agreement with experimental data is satisfactory.

Tsang, T.↗

NASA NTRS1984

Diamagnetism and charge transfer in graphite intercalation compounds

The magnetic susceptibilities at 300 K of the acceptor-type intercalation compounds of graphite with Br2 and ICl are calculated; the results are compared with published experimental measurements in graphs; and the charge-transfer parameter f is inferred using a rigid-band model (Loughin et al., 1978; Weinberger et al., 1978; Mattix et al., 1983). Assuming a screening length of 200 pm, the values determined are f = 0.3 for C(8N)Br2 and f = 0.09 for C(13N)ICl.

Tsang, T.↗