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| - [[ajm:orient:energy-calculations|Energy Calculations]] - [[ajm:orient:optimization|Geometry Optimization]] - [[ajm:orient:basin-hopping|Basin-Hopping simulations]] - [[ajm:orient:dispersion-models|Dispersion Models]] - [[ajm:orient:compilation-instructions|Compilation Instructions]] - [[ajm:orient:display|Using the Display]] This is a large tutorial that describes a number of ways of using the Orient Display module and includes making difference maps. - [[ajm:camcasp:potentials|Potential fitting using Orient & CamCASP]] - [[ajm:orient:rotating-data|Rotating (& transferring) data to and from a local axis frame]] |
1. [[ajm:orient:energy-calculations|Energy Calculations]] 1. [[ajm:orient:optimization|Geometry Optimization]] 1. [[ajm:orient:basin-hopping|Basin-Hopping simulations]] 1. [[ajm:orient:dispersion-models|Dispersion Models]] 1. [[ajm:orient:compilation-instructions|Compilation Instructions]] 1.[[ajm:orient:display|Using the Display]] This is a large tutorial that describes a number of ways of using the Orient Display module and includes making difference maps. 1. [[ajm:camcasp:potentials|Potential fitting using Orient & CamCASP]] 1. [[ajm:orient:rotating-data|Rotating (& transferring) data to and from a local axis frame]] |
Contents
The Orient Program
Full documentation of the **Orient** program is at Stone: Programs. Local versions of the manual are here:
Here we describe some of the functionality of **Orient** we use the most.
Compilation Instructions 1.Using the Display This is a large tutorial that describes a number of ways of using the Orient Display module and includes making difference maps.
Rotating (& transferring) data to and from a local axis frame