Gaussian
an archive of posts with this tag
| Jan 21, 2025 | A New 3D NICS Method Based on ESP Mapping |
|---|---|
| Feb 12, 2024 | Gaussian 16 Calculation Task Continuation |
| Sep 30, 2023 | Computing Charge Transfer Rate Based on Marcus Theory Using Gaussian |
| Apr 28, 2023 | Natural Transition Orbitals (NTO) Analysis |
| May 13, 2022 | MEMO: Install Gaussian and GaussView on Linux Machine |
| Apr 27, 2022 | Evaluating Dissected NICS with NBO Program |
| Feb 17, 2022 | Calculation of Solvation Free Energy |
| Sep 03, 2021 | NMR Prediction with Scaling Factors |
| Sep 02, 2021 | Manual for Calculating NICS with NBO Program |
| Aug 25, 2021 | Install Gaussian 16 on a Mac |
| Jun 22, 2021 | Methods to Solve the SCF not Converged |
| Jun 06, 2021 | Gaussian Common Errors and Solutions |
| Jun 05, 2021 | Visualization of Aromaticity: GIMIC |
| Jun 05, 2021 | Visualization of Aromaticity: AICD |
| Jun 02, 2021 | Diradical Character Calculation |
| Apr 19, 2021 | Plot Odd Electron Density |