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Crystal structure visualization can be integrated into a crystallographic database. Alternatively, the crystal structure data are exchanged between the database and the visualization software, preferably using the CIF format. [33] Web-based crystallographic databases can integrate crystal structure visualization capability. [34]
Extended Wulff constructions refers to a number of different ways to model the structure of nanoparticles as well as larger mineral crystals, and as such can be used to understand both the shape of certain gemstones or crystals with twins.as well as in other areas such as how nanoparticles play a role in the commercial production of chemicals using heterogeneous catalysts.
In crystallography, crystal structure is a description of ordered arrangement of atoms, ions, or molecules in a crystalline material. [1] Ordered structures occur from intrinsic nature of constituent particles to form symmetric patterns that repeat along the principal directions of three-dimensional space in matter.
Overview of a data-modeling context: Data model is based on Data, Data relationship, Data semantic and Data constraint. A data model provides the details of information to be stored, and is of primary use when the final product is the generation of computer software code for an application or the preparation of a functional specification to aid a computer software make-or-buy decision.
General 3D mathematics with modelling and visualization of geoscience data ModelGeo AS Free for non-profit use Windows C++, TCL: Originally a petroleum geology program, reads all common geology and geophysics data formats ParaViewGeo [22] Geoscience extension of ParaView Includes readers and filters Kitware ParaView, Objectivity Originally ...
Mineral resource estimation is used to determine and define the ore tonnage and grade of a geological deposit, from the developed block model. There are different estimation methods used for different scenarios dependent upon the ore boundaries, geological deposit geometry, grade variability and the amount of time and money available.
For economic geology such as petroleum and mineral development, as well as research, modeling of structural geology is becoming increasingly important. 2D and 3D models of structural systems such as anticlines, synclines, fold and thrust belts, and other features can help better understand the evolution of a structure through time.
Once the model of a molecule's structure has been finalized, it is often deposited in a crystallographic database such as the Cambridge Structural Database (for small molecules), the Inorganic Crystal Structure Database (ICSD) (for inorganic compounds) or the Protein Data Bank (for protein and sometimes nucleic acids). Many structures obtained ...