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Python |
45 |
The official AiiDA plugin for Quantum ESPRESSO |
Apr 24, 2023 |
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Python |
3 |
The AiiDA plugin for Quantum ESPRESSO Pinball. |
Nov 02, 2022 |
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Python |
2 |
AiiDA plugin for the Hubbard module of Quantum ESPRESSO |
Apr 19, 2022 |
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HTML |
9 |
Quantum ESPRESSO Calculator for Atomic Simulation Environment (ASE). |
Apr 11, 2023 |
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Julia |
5 |
Automatic differentiable quantum circuit simulation. |
Jan 28, 2023 |
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Gnuplot |
6 |
Compatible with Quantum Espresso-5.4.0. |
Nov 21, 2022 |
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Fortran |
6 |
SIRIUS-enabled Quantum ESPRESSO |
Dec 14, 2022 |
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Jupyter Notebook |
13 |
Tutorials for Quantum Espresso |
May 15, 2023 |
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Shell |
2 |
Quantum ESPRESSO Debian Package |
Aug 16, 2022 |
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Python |
12 |
AiiDA plugin for Quantum Package 2.0 |
Mar 07, 2022 |
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Shell |
2 |
Introduction to shell scripts and Quantum Espresso |
Apr 17, 2022 |
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Python |
4 |
Python wrapper for Quantum Espresso with automated routines and plotting. |
Apr 17, 2022 |
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Fortran |
3 |
band unfolding using quantum espresso |
Jun 16, 2022 |
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Python |
19 |
ase interface for Quantum Espresso |
Jul 07, 2022 |
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Python |
5 |
AiiDAlab App for Quantum ESPRESSO |
Jan 27, 2023 |
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Python |
2 |
ASE interface for Quantum Espresso |
Apr 23, 2024 |
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Python |
7 |
AiiDA plugin for Gaussian quantum chemistry software |
Apr 14, 2023 |
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Julia |
2 |
A Julia wrapper of Quantum ESPRESSO commands with configurations |
Oct 25, 2021 |
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Python |
7 |
Projected Electronic Bands in Quantum Espresso |
Nov 08, 2022 |
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Dockerfile |
2 |
Docker image recipe for Quantum ESPRESSO |
Dec 04, 2023 |
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Python |
11 |
Quantum systems simulation with PyTorch. |
Mar 26, 2023 |
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Python |
2 |
AiiDA plugin for the Psi4 Quantum Chemistry package |
Mar 01, 2024 |
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Python |
2 |
several supporting tools for Quantum-espresso and EPW calculation |
Mar 03, 2023 |
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Fortran |
2 |
Utilities related to running Koopmans-compliant functionals with Quantum ESPRESSO |
Nov 25, 2022 |
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Python |
10 |
Python scripts to postprocess Quantum Espresso calclations. |
May 04, 2022 |
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None |
11 |
Demystify the undocumented Quantum ESPRESSO input/output |
Jun 13, 2021 |
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Rust |
8 |
Quantum Simulation Toolkit |
May 01, 2023 |
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Jupyter Notebook |
2 |
quantum espresso interface for pyiron based on ase |
Jun 08, 2022 |
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Python |
20 |
A set of useful tools for Quantum ESPRESSO |
Mar 22, 2023 |
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Jupyter Notebook |
28 |
New version of dft-book for Quantum Espresso |
Nov 14, 2022 |
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Python |
9 |
Implementation of Koopmans-compliant functionals in Quantum ESPRESSO |
Mar 08, 2023 |
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Python |
3 |
Automatic telluric correction for ESPRESSO and NIRPS ESO pipelines |
Apr 14, 2023 |
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Python |
2 |
Registry of simulation codes and computers for easy setup in AiiDA. |
Feb 14, 2024 |
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Fortran |
10 |
Compiled binaries and sources of Quantum ESPRESSO, redistributed by AdvanceSoft Corp. |
Jul 09, 2021 |
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Gnuplot |
10 |
Advanced Quantum ESPRESSO tutorial: Hubbard and Koopmans functionals from linear response |
Apr 16, 2023 |
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Jupyter Notebook |
52 |
Notes and tutorials on density functional theory calculation using Quantum Espresso. |
May 10, 2023 |
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Jupyter Notebook |
4 |
Some python scripts for setting up and analyzing Quantum Espresso calculations. |
Mar 08, 2023 |
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Python |
11 |
A python utilities to handle with atomic structures and interfacing with common formats (xyz and … |
Nov 28, 2022 |
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Tcl |
4 |
Automatic mirror of Decent Espresso DE1 software |
Sep 08, 2020 |
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Python |
2 |
Quantum mechanics simulation library |
Feb 28, 2023 |
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Python |
5 |
Simulation of lasing networks with quantum graphs and SALT theory. |
Apr 17, 2023 |
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Python |
2 |
Repo for python code used to control Quantum ESPRESSO |
Apr 24, 2021 |
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Python |
3 |
A simulation platform for quantum communcation with a focus on quantum repeaters. |
May 08, 2023 |
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CSS |
8 |
Quantum Computing Circuit Simulation with Quil as background |
Jun 18, 2019 |
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Perl |
2 |
2D quantum square well simulation |
Feb 03, 2017 |
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Julia |
2 |
Simulation routines for quantum gates |
Jun 11, 2020 |
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Jupyter Notebook |
10 |
Simulation and visualization of quantum error correcting codes |
May 26, 2022 |
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C++ |
2 |
A visual quantum circuit design and simulation tool. |
Dec 29, 2015 |
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C |
5 |
Proteus simulation for fan with both manual and automatic mode |
Feb 13, 2023 |
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Python |
2 |
AiiDA plugin for the FLEXPART code (simulation of atmospheric transport processes) |
Dec 20, 2023 |