废除
发表于 2025-3-23 12:00:07
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overbearing
发表于 2025-3-23 13:56:49
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Free-Radical
发表于 2025-3-23 19:46:25
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初次登台
发表于 2025-3-24 00:09:33
Efficient Numerical Techniques for the Calculation of KKR Structure Constantsg of standard formulas for the structure constants, the present approach enables them to be evaluated by expending computer times which are of the same order as the times required to calculate the KKR determinants from their matrix elements.
影响深远
发表于 2025-3-24 05:32:52
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通便
发表于 2025-3-24 07:36:55
NQRS Data for AgGaSe2 (Subst. No. 0010),unctions present in the valence wave function expansion correctly simulate the behavior of the valence wave function in the core regions; while the plane-wave terms adequately describe the overall crystalline behavior of the function.
BAIT
发表于 2025-3-24 11:20:52
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Ascendancy
发表于 2025-3-24 17:17:33
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MAPLE
发表于 2025-3-24 19:08:15
An RAPW Expanded Basis Set the spin-orbit coupling term has been included. This makes the RAPW method considerably more time consuming to apply because it doubles the size of the basis set in addition to making the matrix elements slightly more complicated.
嘴唇可修剪
发表于 2025-3-25 01:50:47
Self-Consistent Orthogonalized-PLane-Wave Calculationsunctions present in the valence wave function expansion correctly simulate the behavior of the valence wave function in the core regions; while the plane-wave terms adequately describe the overall crystalline behavior of the function.