CRYSTALS

15.4

CRYSTALS documentation

Contents:

Crystals User Guide
Crystals Reference Manual
Cameron Manual
- Introduction
- How To Get Started
- Data Input
  - Input of CRYSTALS List 5 files
    - INPUT
- Outputting Data
  - OUTPUT
- Editing The Atom List
  - RENAME
  - RETYPE
- Obeying Files
  - OBEY
- Archiving And Retrieving Views
  - ARCHIVE
  - RETRIEVE
- Graphical Output Devices
  - SCREEN
  - HARDCOPY
- View Direction Control
  - BASIC CONTROL
    - XROT
    - YROT
    - ZROT
    - ROT
    - CURSOR
  - ORIENTATION COMMANDS
    - PLANE
    - FACE
    - ALONG
    - VERTICAL
    - HORIZONTAL
    - BISECT
  - Other related commands
    - VIEW
    - COPY
    - MATRIX
    - STEREO
    - NOSTEREO
  - PHOTOGRAPHS
    - PHOTO
- Include And Exclude
- Drawing Style Control
  - LINE
  - BALL
  - ELLIPSE
  - ALL
  - FRAGMENT
  - GROUP
  - LINE commands.
  - BALL commands.
  - ELLIPSE commands
- Connectivity Control
  - CONNECT
    - CONNECT
    - JOIN
    - REMOVE
    - DISCONNECT
  - Miscellaneous CONNECT commands
- Control Of Colour
  - COLOUR
  - Example
- Atom Labelling
  - LABEL
  - NOLABEL
  - FONT
  - TEXT
- Other Picture Controlling Commands
  - MAXIMISE
  - SCALE
- Symmetry Input
- Crystal Packing Commands
  - PACK
    - CELL
    - WINDOW
  - Dealing with connectivity
    - INTRA
    - INTER
    - KEEP
    - INTRA
    - INTER
    - KEEP
  - EXAMPLES
  - ENCLOSURE
  - Choice of enclosure “origin”
    - ATOM
    - POINT
  - Type of volume to be used
  - EXAMPLE
  - PACKING MORE COMPLICATED STRUCTURES
    - GROUP
  - UNPACK
- Add And Move - Further Symmetry Related Commands
  - ADD
    - ATOMS
    - ALL
    - INITIAL
    - GROUP
  - EXAMPLES
  - MOVE
    - ATOMS
    - ALL
    - GROUP
    - INITIAL
- Distance And Angle Calculations
  - DISTANCE
  - Method of Calculation
    - ANGLE
    - TORSION
- Information On Data Held Within The Program
  - INFORMATION
- Group Definitions
  - DEFGROUP
  - Example
- Miscellaneous Commands
  - RESET
  - LOG
  - EDIT
  - MENUS
  - ISSUE
  - PRINT
- How To Stop The Program
  - END
- Menu Definition File
- Some Useful Ideas

CRYSTALS

Crystals User Guide
Installation
View page source

Installation

Download the latest CRYSTALS installer from http://www.xtl.ox.ac.uk/.

Double click the downloaded file to start the installation.
Choose a location to install.

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© Copyright 2024, Richard Cooper, David Watkin.

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