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Error Estimates of Some Numerical Atomic Orbitals in Molecular Simulations
42115 4726 Pages:125-146 -
Layer-Splitting Methods for Time-Dependent Schrödinger Equations of Incommensurate Systems
49888 3323 Pages:1474-1498 -
A Mortar Spectral Element Method for Full-Potential Electronic Structure Calculations
48361 3367 Pages:1541-1569
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