Hydrogen electron orbitals, and the software to render them.
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May 20, 2023 - Python
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orbitals
Here are 14 public repositories matching this topic...
A python module implementing accurate Hartree-Fock Slater orbitals for atoms under spherical symmetry.
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Sep 18, 2024 - Python
Source code of the Hydrogen Atom Orbitals app for Android
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Jan 24, 2024 - Java
Make interactive scatterplots of atomic orbitals and animate them.
toml cross-platform small scientific-visualization tiny quantum-chemistry scatter-plot cli-app simulations matplotlib plotting visualizations interactive-visualizations schrodinger-equation 3d-animation scatterplot quantum-physics 3d-plot orbitals wavefunction
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Mar 25, 2024 - Python
Analyzes the section 'LOEWDIN REDUCED ORBITAL POPULATIONS PER MO' in ORCA output files.
python dft python3 computational-chemistry quantum-chemistry population output orca orbitals orca-quantum-chemistry loewdin
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Feb 7, 2019 - Python
Python script to visualize spherical harmonics.
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Jul 27, 2020 - Python
A program for Maximum Bonding Fragment Orbital (MBFO) analysis
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Jun 18, 2023
Code to generate a 2D/3D orbital of any element using Numpy and Matplotlib python modules, Bohmian's Trajectory, and the Schrödinger equation.
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Apr 4, 2023 - Python
Computations with orbital graphs in GAP
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Jun 15, 2024 - Jupyter Notebook
Visualization of the hydrogen atom orbitals using the analytical solution of the time independent Schrodinger equation for the hydrogen atom
visualization atom quantum-mechanics schrodinger-equation analytical-solution hydrogen-atom orbitals
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Feb 3, 2021 - C++
Here we are trying to model & simulate the band structures (tightbinding, FDTD, PWE (plane wave expansion), Density Functional theory (DFT), ...)
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Mar 3, 2022 - Jupyter Notebook
Use Blender's powerfull raytracing engine to plot atomic wavefunctions and probability densities in 3D space.
electron visualization distribution atomic blender functions quantum probability plot density wave raytracing hydrogen mechanical osl 3d harmonics wavefunctions spherical orbitals
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Dec 11, 2024
Hartree fock method implementation
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Apr 30, 2022 - C++
Changes the phases in a Gaussian cube file
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Oct 28, 2018 - Python
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