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Error Estimates of Some Numerical Atomic Orbitals in Molecular Simulations
42030 4648 Pages:125-146 -
Layer-Splitting Methods for Time-Dependent Schrödinger Equations of Incommensurate Systems
49794 3293 Pages:1474-1498 -
A Mortar Spectral Element Method for Full-Potential Electronic Structure Calculations
48261 3331 Pages:1541-1569
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