压榨机 发表于 2025-3-21 16:30:03
书目名称Electronic Structure and Physical Properties of Solids影响因子(影响力)<br> http://impactfactor.cn/if/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids影响因子(影响力)学科排名<br> http://impactfactor.cn/ifr/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids网络公开度<br> http://impactfactor.cn/at/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids网络公开度学科排名<br> http://impactfactor.cn/atr/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids被引频次<br> http://impactfactor.cn/tc/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids被引频次学科排名<br> http://impactfactor.cn/tcr/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids年度引用<br> http://impactfactor.cn/ii/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids年度引用学科排名<br> http://impactfactor.cn/iir/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids读者反馈<br> http://impactfactor.cn/5y/?ISSN=BK0306416<br><br> <br><br>书目名称Electronic Structure and Physical Properties of Solids读者反馈学科排名<br> http://impactfactor.cn/5yr/?ISSN=BK0306416<br><br> <br><br>outrage 发表于 2025-3-21 22:40:48
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https://doi.org/10.1007/3-540-46437-9Electronic structure; Magnetism; Numerical simulation of material; Potential; Surface and alloy^; alloy; c外表读作 发表于 2025-3-22 05:33:12
Mark A. Tomai,John P. Vasilakosd potential in the this method are represented with no inherent geometrical approximation. This method allows the calculation of total energies and forces with arbitrary accuracy while sacrificing much of the efficiency and physical content of approximate methods such as the LMTO-ASA method.Protein 发表于 2025-3-22 10:15:35
Full-Potential LMTO Total Energy and Force Calculationsd potential in the this method are represented with no inherent geometrical approximation. This method allows the calculation of total energies and forces with arbitrary accuracy while sacrificing much of the efficiency and physical content of approximate methods such as the LMTO-ASA method.defendant 发表于 2025-3-22 16:03:28
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Emerging Technologies and Health,l techniques, we have developed a . (FCD) method. In this method the charge density is obtained from the output of self-consistent linear muffin-tin orbitals (LMTO) ASA calculations, the Coulomb energy is calculated exactly from the complete, nonspherically symmetric charge density defined within no巨头 发表于 2025-3-23 00:00:17
Andreas Langer,Johannes Eurich,Simon Güntnerte the forces accurately. Similar to previous approaches, this method uses numerical integration to calculate the matrix elements for the interstitial potential, which is the limiting step for any FP-LMTO approach. However, in order to reduce the numerical e.ort as far as possible, we use a newly inoptic-nerve 发表于 2025-3-23 02:21:36
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Justice- and temporality-related findings,extended to calculate the spectroscopic properties of materials form first principles, i.e, optical spectra, x-ray magnetic circular dichroism (XMCD) and magneto-optical kerr effect (MOKE). The paper describes an overview of the FP-LMTO basis set and the calculation of the momentum matrix elements.