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Getting Started

What is SiestaStudio
Create an account
Your first calculation
Studio tour
FAQ

Building Inputs

Structure builder
Import and export structures
Pseudopotentials
Basis sets
Presets and templates
Validation and FDF preview

Projects & Collaboration

Projects
Calculations
Sheets
Collaboration
Saved analyses

Running on HPC clusters

Connecting a cluster
The terminal
Run on cluster
Pulling results
Job watching and auto-import

Analysis tools

Analysis tools overview
Potential profile
DOS and band structure
Projected DOS (PDOS)
Structure visualizer
Subprogram outputs

Account & data

Profile and preferences
Notifications
Data export and deletion
HPC credential security

Reference

Project Setup
Atomic Structure
Spin & Magnetism
Real-Space Grid
Molecular Dynamics & Relaxation
K-Point Sampling
Exchange-Correlation Functional
Self-Consistent Field (SCF)
Charge, Dipole & Electric Fields
Basis Set Generation (PAO)
Hamiltonian & Overlap
Van der Waals Corrections (DFT-D3)
DFT+U Correction
Chemical Analysis
Density of States & Band Structure
Optical Properties
Wannier90 Interface
Efficiency & Timing
External Control & Scripting
Grid & Output Files
NetCDF Options
RT-TDDFT

SiestaStudio documentation

Guides for building, running, and analyzing SIESTA calculations.

What is SiestaStudio
Create an account
Your first calculation
Studio tour
FAQ
Structure builder
Import and export structures
Pseudopotentials