Sentence examples for displacement parameters for from inspiring English sources
Refinements were performed with SHELXL-97 using full-matrix least-squares, with anisotropic displacement parameters for all the non-hydrogen atoms.
The refinements were made by full-matrix least-squares on F 2, with anisotropic displacement parameters for all non-hydrogen atoms.
A full-matrix least-squares refinement on F 2 was employed with anisotropic temperature displacement parameters for all non-hydrogen atoms for all compounds.
Robustness of the display is proven by insignificant variations of the performance (quality factor, resonance frequency and peak displacement) parameters for 3 million cycles.
The atomic coordinates and isotropic atomic displacement parameters for the Ba and Ge atoms are determined through Rietveld refinement with synchrotron X-ray data.
The crystal structure was solved by direct methods and refined by full-matrix least squares methods based on F2 values against all reflections including anisotropic displacement parameters for all non-H atoms.
The average atomic displacement parameter for the M domains is B∼85 Å2, considerably higher than the 55 Å2 observed for the NG domains; this intrinsic flexibility has been proposed to be important for the ability to recognize diverse signal sequences at different states of exit from the ribosome.
A poorly resolved pentane solvent molecule co-crystallized with [NiFe('S2Se2')(CO)3] and it was modeled as one half-weight molecule disordered about an inversion center with geometric restraints and a common isotropic displacement parameter for the carbon atoms.
Refined values of unit cell dimensions and positional and displacement parameters of atoms for sol-gel-derived La0.5Sm0.5FeO3 samples, heat treated at 1073 and 1473 K, as well as the La1−x Sm x FeO3 specimens with x = 0.2, 0.4, 0.6 and 0.8, obtained by traditional ceramic technology are presented in Table 1.
More pronounced anisotropic behaviour is observed for the displacement parameters of oxygen species, reflected in the remarkable contraction or elongation of the corresponding ellipsoids in c-direction (Table 1).
The unstable displacement parameters of DME atoms were restrained.
