User Guide#
Table of Contents
- Using this Guide
- Overview of Nexus
- Nexus Installation
- Complete Examples
- Nexus Execution Behavior
- Nexus User Scripts
- Detailed Nexus Job Usage
- Setting the Default Machine
- Attaching Jobs to Simulations
- Choose Cores, Nodes, and Threads
- Running Serial or Threaded-Serial (non-MPI) Codes
- Specifying the Application
- Setting Job Walltimes
- Adding Environment Variables and Shell Snippets to Jobs
- Passing Options to Jobs
- Using Batch-Specific Keywords When Needed
- Local Execution and Skip-Submit
- Using Full Commands to Override Job Defaults
- Common Recipes from the Examples
- Verifying and Debugging Generated Scripts
- Modifying Existing QMCPACK Input Files with Nexus Tools
- Generating QMCPACK input files
- Running QMCPACK restarts
- Adding a Supercomputer Machine