most citedThe multi-configurational time-dependent Hartree approach in optimized second quantization: imaginary time propagation and particle number conservation

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physics.chem-ph2019★ 16 cited

The multi-configurational time-dependent Hartree approach in optimized second quantization: imaginary time propagation and particle number conservation

Thomas Weike, Uwe Manthe

The multi-layer multi-configurational time-dependent Hartree (MCTDH) in optimized second quantization representation (oSQR) approach combines the tensor contraction scheme of the m…