gimic
Current density calculator
Calculates magnetically induced currents in molecules using gauge-including atomic orbitals
Gauge-including magnetically induced currents.
28 stars
6 watching
19 forks
Language: Python
last commit: 12 months ago currentsquantum-chemistry
Related projects:
| Repository | Description | Stars |
|---|---|---|
 jcmgray/quimb | A Python library for performing 'quantum information many-body' calculations using tensor networks. | 499 |
 qmlcode/qml | A toolkit for representing and learning properties of molecules and solids using quantum machine learning concepts | 199 |
 iqm-finland/kqcircuits | A Python library for designing 2D quantum circuit geometries using the KLayout layout design API. | 140 |
 octaprog7/qmc5883 | MicroPython module for controlling a geomagnetic sensor | 0 |
 pyriemann/pyriemann-qiskit | This library provides tools and classes to interface with Qiskit for machine learning and quantum programming using Riemannian geometry. | 23 |
 jposada202020/micropython_mmc5983 | A MicroPython library providing access to the MMC5983 Magnetometer's sensor data and temperature readings. | 0 |
 cgohlke/molmass | Calculates molecular properties from chemical formulas | 58 |
 quantum-visualizations/qmsolve | A Python module for solving and visualizing the Schrödinger equation in quantum mechanics | 904 |
 bobbypaton/goodvibes | A Python package to compute thermochemical data from electronic structure calculations | 1 |
 localminimum/qanet | An implementation of Google's QANet for machine reading comprehension using TensorFlow. | 983 |
 sunhongfu/qsm | A collection of MATLAB codes and tools for reconstructing quantitative susceptibility mapping (QSM) images from MRI scans. | 72 |
 sunqm/pyscf | A Python module for performing quantum chemical simulations of chemistry. | 68 |
 cyllab/calcus | A web-based platform for performing quantum chemistry calculations and analysis. | 68 |
 doyle-lab-ucla/auto-qchem | Automated workflow for generating and storing DFT calculations for organic molecules using Python and machine learning. | 88 |
 cda-tum/mqt-ddsim | A tool for simulating quantum circuits based on decision diagrams. | 142 |