CCQC / summer-programLinks
Repository for all summer program related programs
☆47Updated 2 months ago
Alternatives and similar repositories for summer-program
Users that are interested in summer-program are comparing it to the libraries listed below
Sorting:
- TheoDORE - A package for Theoretical Density, Orbital Relaxation and Exciton analysis☆35Updated 3 months ago
- ☆48Updated this week
- Python library for analytical evaluation and integration of Gaussian-type basis functions and related quantities.☆55Updated 3 weeks ago
- The SHARC molecular dynamics (MD) program suite is an ab initio MD software package developed to study the excited-state dynamics of mole…☆74Updated 5 months ago
- Coupled-cluster package written in Python.☆46Updated last week
- An Educational Hartree-Fock Code in Python: Transparent Implementation of Gaussian-Type Integrals, SCF Procedures, and Geometry Optimizat…☆35Updated 3 weeks ago
- Crawford's Quantum Chemistry Exercises by Python approach☆32Updated 3 years ago
- I can't believe it's NonAbelian!☆28Updated 3 months ago
- adcc: Seamlessly connect your program to ADC☆38Updated 3 weeks ago
- PySOC: python+fortran, spin-orbit coupling, LR-TD-DFT, TDA, TD-DFTB, Gaussian 09, DFTB+☆43Updated last year
- A flexible ab-initio quantum chemistry library for (parameterized) configuration interaction calculations.☆22Updated 3 weeks ago
- ☆52Updated this week
- Automated Generation of Machine Learning Models of Molecular Potential Energy Surfaces☆73Updated 3 months ago
- do a simple closed shell Hartree-Fock using McMurchie-Davidson to compute integrals☆83Updated last year
- Solution of Hartree-Fock equations within Pople's STO-3G basis set