HartreeFock
KKR
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HartreeFock | KKR | |
---|---|---|
15 | 6 | |
49 | 16 | |
- | - | |
7.1 | 5.7 | |
2 months ago | 2 months ago | |
C++ | C++ | |
GNU General Public License v3.0 only | GNU General Public License v3.0 only |
Stars - the number of stars that a project has on GitHub. Growth - month over month growth in stars.
Activity is a relative number indicating how actively a project is being developed. Recent commits have higher weight than older ones.
For example, an activity of 9.0 indicates that a project is amongst the top 10% of the most actively developed projects that we are tracking.
HartreeFock
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Help making plot for experiment
For this one I used my own code that draws the chart: https://github.com/aromanro/HartreeFock
- Algoritm pentru verificare daca reshape este posibil fara copiere de date la array multidimensional
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GPT3 is a sad reality
Try to obtain this https://github.com/aromanro/HartreeFock from GPT3 and see what you really get out of it.
- Ce parere aveti despre Chat-GPT? Tocmai ce am creat un mic "shopping" website cu ajutorul lui:
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The connection between math and CS
I have some projects on that topic here: https://github.com/aromanro?tab=repositories since it's one of my hobbies. If I would have to point out one of them for the usage of maths, I could point out this one: https://github.com/aromanro/HartreeFock but there are plenty of other projects there that requires quite a bit of mathematics to understand and implement.
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Where does the math in quantum mechanics get "hard"?
Here is my implementation of that algorithm (together with some other stuff, like perturbation theory, coupled-cluster, configuration-interaction and so on): https://github.com/aromanro/HartreeFock
- Sa iau o pauza de la proiecte personale?
- Did I just understand Quantum Theory?
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What’s your favourite programming project that you’ve completed?
From the open source ones, probably this one: https://github.com/aromanro/HartreeFock It started 'small' then I extended it based on tutorials from here: https://github.com/CrawfordGroup/ProgrammingProjects (and not only).
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Proiecte
Cel mai complex proiect personal e asta: https://github.com/aromanro/HartreeFock
KKR
- Creative block si harababura din open source
- Cum faceti lucruri dificile?
- ChatGPT, azi programator, maine somer?
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Niște sfaturi?
Proiectul asta: https://github.com/aromanro/KKR poate fi extins: https://github.com/aromanro/KKR/issues
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Approximately how many hours do you spend on one personal project?
For example, I've made this https://github.com/aromanro/KKR in a matter of days.
- Programatori care NU ati terminat o facultate, v-a incurcat vreodata cu ceva acest aspect?
What are some alternatives?
nwchem - NWChem: Open Source High-Performance Computational Chemistry
EventMolecularDynamics - A program implementing event driven molecular dynamics for hard smooth spheres, using OpenGL for displaying
RayTracer - A ray tracing program
turbulucid - A Python package for visualising 2D CFD datasets.
matplotplusplus - Matplot++: A C++ Graphics Library for Data Visualization 📊🗾
DFTQuantumDot - Density Functional Theory with plane waves basis, applied on a 'quantum dot'. Volumetric visualization of orbitals with VTK
psi4 - Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
MuST - Multiple Scattering Theory code for first principles calculations
DFTAtom - Density Functional Theory in real space, for atoms, LDA and LSDA
EmpiricalPseudopotential - Band structure computation using empirical pseudopotentials