Sentence examples for intermolecular contribution from inspiring English sources

At this ratio, the intermolecular contribution is >25%.

This was done by minimizing the lattice energy (Elatt), calculated as the sum of the intermolecular contribution (Uinter), and the conformational energy penalty (Δ Eintra) paid for distortion of the molecular geometry to improve the hydrogen bonding geometries.

The intermolecular contributions to SaO are only due to CONH residues in these polymers.

The conformational and intermolecular contributions to the residual enthalpy ΔHO and entropy SaO at 0 K for amorphous nylon-6 and nylon-6,6 were investigated on the basis of the derivation of a new relationship between Cp and Cv.

Impedimetric measurements in solution containing [Fe CN 6]3−/4− redox probe and D-mannose sugar at different concentrations indicate hydrogen bonds are the major intermolecular contributions connecting the sugar molecules to the sugar recognition sites of ConBr where Ca2+ and Mn2+ ions are inserted.

At this stage we have not analyzed the intermolecular contributions to singlet relaxation.

All other intermolecular contributions to the lattice energy were represented by empirical exp-6 potentials, using either the FIT or Williams01 parameters.

Specifically, the PRE results obtained for mutants C108 and C188 provide clear evidence of the prevalence of a structurally compact region in OPN encompassing residues 100 200 (recall that intermolecular contributions can be ruled out by DEER on the single mutants at the given concentration).

S hbond ext) measures the intermolecular hydrogen bond contributions to binding, and S lipo) is a lipophilic term that is calculated between nonpolar carbon, nonionic chlorine, bromine, and iodine, and nonaccepting sulphur atoms [ 29].

These contributions are typically one tenth of the intermolecular dipolar self-relaxation contributions, that is, on the order of 0.1 Hz and consequently they have not been included in the numerical simulations, here.

To investigate the competition between halogen bond and electrostatic interaction and their influence on the crystal packing, four novel solvates of 1,3,5-trichloro-2,4,6-trinitrobenzene (TCTNB) and 1,3,5-tribromo-2,4,6-trinitrobenzene (TBTNB) were synthesized while the intermolecular forces and the contribution of each interaction were analyzed quantitatively.