Repository for all summer program related programs
☆48May 6, 2026Updated last month
Alternatives and similar repositories for summer-program
Users that are interested in summer-program are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A step-by-step tutorial to code the McMurchie-Davidson scheme to compute molecular integrals☆10Jul 4, 2021Updated 4 years ago
- Multipurpose ab initio MD program.☆12May 30, 2026Updated last week
- Projectively-optimized geminal and "fancyCI" wavefunctions☆17Aug 18, 2022Updated 3 years ago
- quantum chemistry common driver and databases☆16Dec 6, 2022Updated 3 years ago
- Open source stochastic quantum chemistry☆81Dec 17, 2025Updated 5 months ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- ☆14Feb 20, 2025Updated last year
- optking: A molecular geometry optimization program☆27Jun 1, 2026Updated last week
- Quick Reaction Coordinate: normal mode displacement of transition structures☆44Mar 3, 2026Updated 3 months ago
- PyHEOM: Python 3 library to simulate open quantum dynamics based on HEOM theory☆16Updated this week
- Combining Psi4 and Numpy for education and development.☆396Jan 8, 2024Updated 2 years ago
- Tools to facilitate input generation and analysis of FCclasses (see http://www.iccom.cnr.it/en/fcclasses)☆18Jan 23, 2026Updated 4 months ago
- An Educational Hartree-Fock Code in Python: Transparent Implementation of Gaussian-Type Integrals, SCF Procedures, and Geometry Optimizat…☆60Apr 24, 2026Updated last month
- This is a C version of the SCF code found in Appendix B of Modern Quantum Chemistry, An Introduction to Electronic Structure Theory by A.…☆10Jan 1, 2019Updated 7 years ago
- Python quantum chemistry (experimental and test routines)☆13May 21, 2021Updated 5 years ago
- Simple, predictable pricing with DigitalOcean hosting • AdAlways know what you'll pay with monthly caps and flat pricing. Enterprise-grade infrastructure trusted by 600k+ customers.
- Automated Generation of Machine Learning Models of Molecular Potential Energy Surfaces☆76Jan 19, 2026Updated 4 months ago
- a unified interface for molecular harmonic vibrational frequency calculations☆33May 15, 2026Updated 3 weeks ago
- ☆61Mar 2, 2026Updated 3 months ago
- Framework for Molecular Aggregate Excitation☆31May 12, 2026Updated 3 weeks ago
- A Quantum Chemistry program written in Python 3 supporting RHF, UHF, TDHF, CIS, MP2, DFT, CCSD and CCSD(T) methods.☆69May 18, 2021Updated 5 years ago
- ☆13Jul 25, 2025Updated 10 months ago
- Quantum simulations of nonlinear spectroscopy and dynamics for molecular aggregates☆19Nov 13, 2021Updated 4 years ago
- Quantum Package : a programming environment for wave function methods☆79May 22, 2026Updated 2 weeks ago
- Fast computation of a gaussian and its derivative on a grid.☆31May 20, 2026Updated 2 weeks ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- C++ Programming Tutorial in Chemistry☆568Dec 30, 2022Updated 3 years ago
- JADE-NAMD: An package for the on-the-fly nonadiabatic molecular dynamics simulation☆21Jun 1, 2021Updated 5 years ago
- Coupled-cluster package written in Python.☆50May 28, 2026Updated last week
- Quantum systems containing matrix elements for second quantized solvers☆11Oct 30, 2024Updated last year
- Molecular structure optimizer☆130May 26, 2026Updated 2 weeks ago
- ☆11Apr 25, 2026Updated last month
- Brilliantly Advanced General Electronic-structure Library☆121Mar 31, 2025Updated last year
- ☆31Apr 16, 2018Updated 8 years ago
- davidson iterative diagonalizer☆12Jun 30, 2021Updated 4 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Resources for teaching quantum chemistry courses in Bonn☆42Apr 23, 2026Updated last month
- ☆12Sep 9, 2020Updated 5 years ago
- Block implements the density matrix renormalization group (DMRG) algorithm for quantum chemistry.☆36Aug 28, 2023Updated 2 years ago
- Coupled Cluster for solids. Mirror of https://gitlab.cc4s.org/cc4s/cc4s☆25Nov 7, 2025Updated 7 months ago
- PyCC is a simple, Python-based, reference implementation of the coupled cluster method of ab initio quantum chemistry.☆62May 24, 2026Updated 2 weeks ago
- A very simple quantum chemistry program☆10Jan 4, 2019Updated 7 years ago
- The course materials for "Machine Learning in Chemistry 101"☆88Oct 19, 2020Updated 5 years ago