CINEMAS-components:
Components of CINEMAS application
CASCADE
Workflows
Color coding of workflows
Copy/Paste feature of workflows
‘Mark-as-important’ feature
Import Calculations
Utility
Automatic Modules
Band-structure Module
DOS Module
Phonopy
Formation Energy Module
Connections
Queue
Python Editor
CINEMAS-view
Structure Visualizer
Structure Manager
Fermi Surface Visualizer
Robocrystallographer
Visualize magnetic configuration
How to visualize magnetic configuration of atoms from an initial or a computed structure(
Mag-View
)
Visualize forces on a computes structure
How to visualize forces on atoms from a computed structure(
Force-View
)
CINEMAS-plot
CINEMAS-plot tables
CINEMAS-plot graphs
CINEMAS-draw
More about CINEMAS-draw
Download CINEMAS:
How to download CINEMAS
How to Install:
Installing CINEMAS
Installer
Potential-files configuration
License:
CINEMAS License
Third Party Licenses
Qwt plotting libraries
Qt License(LGPL)
Libssh2
Pymatgen
Robocrystallographer_License
Miniconda
SpgLib
Xpdf
Phonopy License
Seekpath
CINEMAS Help:
User forum
Start with CINEMAS
How to start with CINEMAS
Create/open a new CINEMAS project
Load DFT-engine input/output file(s)
Import existing calculation(s)
Import VASP input files from materials-project to CINEMAS
How to create input files?
How to setup connections between the local machine and a remote server?
How to manage Job status(Queue)
How to import input-files/data from Materials-project database
Materials-project interface
How to visualize Fermi-surface in CINEMAS
Examples of Nonmagnetic Al
How to use Phonopy automatic module
Phonopy from scratch using a structure file
How to use Elastic automatic module
Calculate Elastic constants from scratch using a structure file
Calculate Elastic constants from a bank template
How to use Dielectric automatic module
Calculate Dielectric constants from scratch using a structure file
Calculate Dielectric constants from a bank template
How to use Surface automatic module
Model a surface slab from scratch using a structure file
How to use AMMCR automatic module to calculate charge mobility
Calculate charge mobility from scratch using a structure file
How to use Featurizer in CINEMAS: an interface to Matminer
Featurize from composition
How to train models using CINEMAS-GUI
Analyse database for model training
Train a regression model in CINEMAS
Train a classification model in CINEMAS
Guide to CINEMAS-bandstructure module
Bandstructure from scratch using a structure file
Bandstructure from a blank template
How to use Kpoints-convergence automatic module
How to visualize forces on atoms from a computed structure(
Force-View
)
How to visualize magnetic configuration of atoms from an initial or a computed structure(
Mag-View
)
Video Tutorials
Dielectric constants: Automatic Module
Elastic constants: Automatic Module
Bandstructure: Automatic module
Visualize magnetic configurations
Visualize forces
Query Materials-project database, and import VASP input files in CINEMAS
Visualize 3D Fermi-surface in CINEMAS
Describe a Structure in CINEMAS, using Robocrystallographer
Import external calculations to CINEMAS and post-process
Configuring Potential file in newer versions(2020)
CINEMAS integrated GUI
Setting up potential files
Create workflows and input files
Connection, transfer files and execute
Structure manager: build surface cell
The CINEMAS team:
Developers’ group members
Advisory board members
Credits
CINEMAS
»
CINEMAS-components
Components of CINEMAS application
¶
CASCADE
Workflows
Color coding of workflows
Copy/Paste feature of workflows
‘Mark-as-important’ feature
Import Calculations
From Materials-project
How to import input-files/data from Materials-project database
Materials-project interface
From disk
Utility
Automatic Modules
Band-structure Module
Guide to CINEMAS-bandstructure module
Bandstructure from scratch using a structure file
Bandstructure from a blank template
DOS Module
Phonopy
How to use Phonopy automatic module
Phonopy from scratch using a structure file
Formation Energy Module
Connections
Queue
Python Editor
CINEMAS-view
Structure Visualizer
Structure Manager
Fermi Surface Visualizer
Robocrystallographer
Visualize magnetic configuration
How to visualize magnetic configuration of atoms from an initial or a computed structure(
Mag-View
)
Visualize forces on a computes structure
How to visualize forces on atoms from a computed structure(
Force-View
)
CINEMAS-plot
CINEMAS-plot tables
CINEMAS-plot graphs
CINEMAS-draw
More about CINEMAS-draw