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 Results for DC.creator="V." AND DC.creator="Favre-Nicolin" in section 4.5.2 of volume H
Modelling of non-molecular compounds
Cernư, R. and Favre-Nicolin, V.  International Tables for Crystallography (2019). Vol. H, Section 4.5.2, p. 442 [ doi:10.1107/97809553602060000960 ]
... and simple algorithm called the dynamical occupancy correction (DOC) by Favre-Nicolin & Cernư (2002 ). For each proposed model, all atom positions ... function penalizing the improbable atomic configurations provides the best results (Favre-Nicolin & Cernư, 2002 ). Similarly, with DOCs the anti-bump cost ... single-crystal neutron diffraction. Inorg. Chem. 22, 1081-1084.GoogleScholar Brodski, V., Peschar, R. & Schenk, H. (2005). Organa - a program ...

Random versus non-random DSM algorithms
Cernư, R. and Favre-Nicolin, V.  International Tables for Crystallography (2019). Vol. H, Section 4.5.2.6, pp. 444-445 [ doi:10.1107/97809553602060000960 ]
Random versus non-random DSM algorithms 4.5.2.6. Random versus non-random DSM algorithms Once the BUs have been defined, several types of algorithms can be used to actually solve the structure: (i) Random, ergodic algorithms such as the reverse Monte Carlo (RMC) or genetic algorithms (GAs) (see Chapter 4.3 ). These ...

Building units and the convergence of the DSM algorithm
Cernư, R. and Favre-Nicolin, V.  International Tables for Crystallography (2019). Vol. H, Section 4.5.2.5, p. 444 [ doi:10.1107/97809553602060000960 ]
... than the nature of the PBUs. References Edgar, M., Carter, V. J., Tunstall, D. P., Grewal, P., Favre-Nicolin, V., Cox, P. A., Lightfoot, P. & Wright, P. A. (2002) ...

Is there a need for precise unit-cell contents?
Cernư, R. and Favre-Nicolin, V.  International Tables for Crystallography (2019). Vol. H, Section 4.5.2.4, p. 444 [ doi:10.1107/97809553602060000960 ]
... References Cernư, R., Chul Kim, K., Penin, N., D'Anna, V., Hagemann, H. & Sholl, D. S. (2010). AZn2(BH4)5 ... studies. J. Phys. Chem. C, 114, 19127-19133.GoogleScholar Guénée, L., Favre-Nicolin, V. & Yvon, K. (2003). Synthesis, crystal structure and hydrogenation ...

Special positions and the sharing of atoms between building units
Cernư, R. and Favre-Nicolin, V.  International Tables for Crystallography (2019). Vol. H, Section 4.5.2.3, pp. 443-444 [ doi:10.1107/97809553602060000960 ]
... and simple algorithm called the dynamical occupancy correction (DOC) by Favre-Nicolin & Cernư (2002 ). For each proposed model, all atom positions ... framework crystal structures by simulated annealing. Nature, 342, 260-262.GoogleScholar Favre-Nicolin, V. & Cernư, R. (2002). FOX, `free objects for crystallography': ...

Building units
Cernư, R. and Favre-Nicolin, V.  International Tables for Crystallography (2019). Vol. H, Section 4.5.2.2, pp. 442-443 [ doi:10.1107/97809553602060000960 ]
... and basic principles. Acta Cryst. 11, 184-190.GoogleScholar Krivovichev, S. V., Mentré, O., Siidra, O. I., Colmont, M. & Filatov, S. K. ...

Principles
Cernư, R. and Favre-Nicolin, V.  International Tables for Crystallography (2019). Vol. H, Section 4.5.2.1, p. 442 [ doi:10.1107/97809553602060000960 ]
Principles 4.5.2.1. Principles The modelling of non-molecular compounds is by nature complex; this is because they are extended solids, and therefore no obvious group of atoms (such as a molecule) can be isolated and used as a building unit (BU) for the entire structure (Fig. 4.5.1 ). This does not ...

The choice of the cost function in DSM algorithms
Cernư, R. and Favre-Nicolin, V.  International Tables for Crystallography (2019). Vol. H, Section 4.5.2.7, p. 445 [ doi:10.1107/97809553602060000960 ]
... function penalizing the improbable atomic configurations provides the best results (Favre-Nicolin & Cernư, 2002 ). Similarly, with DOCs the anti-bump cost ... of the powder diffraction data and crystallographers' experience. References Brodski, V., Peschar, R. & Schenk, H. (2005). Organa - a program package ... by direct-space methods. J. Appl. Cryst. 38, 688-693.GoogleScholar Favre-Nicolin, V. & Cernư, R. (2002). FOX, `free objects for ...

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