DAC_restrict enables you to determine in advance which single-crystal reflections will be accessible from your crystal once it is loaded in to your diamond-anvil cell (DAC), in any specific orientation that you choose. Thus, you can use the program to determine the orientation of your sample that will give the optimal accessibility to reflections, and thus the best possible refined structures at high pressures.
The basic idea is that you first collect a full reflection intensity dataset from your crystal in air, and perform a normal structure refinement. Then you use DAC_restrict to remove from your original dataset all those reflections that will not be accessible when you load your crystal in to the DAC in a given orientation. You can then perform a new refinement on the restricted dataset, to determine the effects on your refined structure. At this point, you may decide to try other orientations of the crystal. Once you have determined the optimal orientation, you can then prepare and load the crystal in to the DAC in this orientation.
Like it? Share with your friends!
Other Windows Software of Developer «Ross Angel»:
POWF POWF is a program to convert powder diffraction datafiles from one format to another. For input file use the upper select button to access a file browser to select a filename. If the program does not recognize the extension on the filename, use the pull-do
Twin Calculator With Twin Calculator, determine the relative orientation of crystals whose orientation matrices have been determined at the same time by single-crystal diffraction. This will work not only for twins but also for any pair of crystals that are in the same sa
Cif Reader Cif Reader is a software tool designed to handle CIFs from parametric refinements, with many data blocks in a single CIF describing the same structure but at a series of temperatures and pressures. The object of the software is two-fold first to provide a
SINGLE SINGLE is a control program for four circle diffractometers equipped with point detectors. It is especially optimized for precise determination of lattice parameters from single crystals, but will perform intensity data collections and other types of scans
Win-IntegrStp Win-IntegrStp is a graphics-based program for Windows to integrate step-scan data from single-crystal diffractometers. It allows the user to examine individual reflections, determine optimum profile parameters and to integrate data-sets automatically or ma
Zref Zref allows you to perform two types of calculations from single-crystal diffraction measurements, in order to determine unit-cell parameters. If you have centred reflections in 8 positions on the diffractometer with the zref command in the Single software
EosFit EosFit is a program to do calculations with equations of state such as producing P-V and K-P curves from EoS parameters, doing P-V integrals, and converting P-V data to f-F plots. It Handles Murnaghan, Birch-Murnaghan, natural strain, and Vinet equations o
Average Average is a program to merge single-crystal X-ray intensity, with options to reject outliers from sets of symmetry-equivalent data, including the effects of "diamond dips" in diamond-anvil cell data. It can be used for data collected with either an area d
Absorb ABSORB is a program for Windows to correct X-ray intensity data from any source and any detector type (lab or synchrotron, point detector or area detector). Corrections can be made for spherical crystals, and crystals with regular or irregular shapes, and
CAD View Plugin for Total Commander CAD View plug-in for Total Commander is a CAD View plug-in provides support for DWG / DXF / HPGL/ SVG / CGM files in Total Commander. It features fast reading in 2D / 3D graphics, mouse wheel zoom, and pan.What is new in this release:Version 8.0.7 fixes bu
LTplus AI-Tool 2009 LTplus AI-Architecture for IntelliCAD Free Demo & Tutorial. Architecture-Application for IntelliCAD / metric architectural / 2D & 3D Visualisation / 3D Modelling & Presentation. LTplus enhances with this English Version IntelliCAD for the use in architect
Points Export for IntelliCAD Points Export for IntelliCAD is a Point Text file export plug-in for IntelliCAD. This plug-in gives IntelliCAD powered applications and the ability to export point data to text files. Points Export for IntelliCAD reads point objects in an IntelliCAD drawin
RA Workshop Advanced Professional Ra Workshop is the best software for windows and doors industry - from resellers and dealers, to manufacturers and suppliers. Ra Workshop can use aluminum, vinyl (uPVC/PVC) or wood profiles and is able to design and compute a great variety of products (win
Point Cloud for Bricscad Point Cloud for Bricscad is a reverse engineering plug-in for Bricscad. This plug-in gives Bricscad the ability to reconstruct the geometry of an object from a point cloud which describes it.
Point Cloud for Bricscad can drape a surface over a point clo
STEP 2D Import for AutoCAD STEP 2D Import for AutoCAD is a STEP file import plug-in for AutoCAD. This plug-in gives AutoCAD the ability to import geometric data from STEP files. The STEP file format is widely used to exchange 3D data between different CAD systems. STEP files contain
InnerSoft CAD for AutoCAD 2005 InnerSoft CAD is a add-on for AutoCAD that install a set of useful tools. It can Export to a Excel Sheet the values of Area/Length property or coordinates for various AutoCAD entities. Import from a Excel Sheet the vertex coordinates for a set of 2D polyli
SimLab 3D PDF Exporter from Google SketchUp 7 SimLab 3D PDF Exporter from Google SketchUp allows the user to generate 3D PDF files from the Google SketchUp environment. It is very easy to use, and allows the user to export 3D PDF files readable by the popular and free Adobe Acrobat reader.What is new
Edge Diagrammer Edge Diagrammer is a professional diagramming, flowcharting, and design tool. It is uniquely tailored for easy use with little or no training required. Create any type of block or flow diagrams. It contains all the features of expensive packages such as f
VideoCAD Starter VideoCAD is a multifunctional tool for CCTV design. VideoCAD Starter - the easiest, low cost version of VideoCAD. VideoCAD Starter is less demanding of computer resources because of absence of resource-intensive tools. VideoCAD Starter is registered only b
Supported Operating Systems:
Windows 7 |
Windows Vista |
Windows XP |
Comments on :
Comments not found
Windows Software - Free Windows Downloads, Apps, Games, Freeware, Skype, Media Player, Antivirus, Gimp, Live, Starter for Windows XP, Vista, 7, 8, 10