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table_of_contents [2023/01/30 09:06] – koehn | table_of_contents [2023/11/26 11:53] – remove mbe may | ||
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- [[Basis set extrapolation]] | - [[Basis set extrapolation]] | ||
- [[The COSMO model]] | - [[The COSMO model]] | ||
- | - [[Calculate grids for visualization in gOpenMol]] | ||
- [[Dump density or orbital values (CUBE)]] | - [[Dump density or orbital values (CUBE)]] | ||
- [[Non adiabatic coupling matrix elements]] | - [[Non adiabatic coupling matrix elements]] | ||
Line 76: | Line 75: | ||
- [[Chemical shieldings, magnetizability, | - [[Chemical shieldings, magnetizability, | ||
- [[Minimization of functions]] | - [[Minimization of functions]] | ||
+ | - [[Nuclear-electronic orbital method]] | ||
- [[Instantons]] | - [[Instantons]] | ||
- [[QM/MM interfaces]] | - [[QM/MM interfaces]] | ||
- [[Periodic-boundary conditions]] | - [[Periodic-boundary conditions]] | ||
- | - [[Many-body expansion]] | ||
- [[Projection-based WF-in-DFT embedding]] | - [[Projection-based WF-in-DFT embedding]] | ||
- [[Embedded many-body expansions]] | - [[Embedded many-body expansions]] |