نتایج جستجو برای: slater orbital
تعداد نتایج: 42308 فیلتر نتایج به سال:
purpose : to present a case of orbital cellulitis secondary to dacryocystitis case report : a 48-year-old postmenopausal lady was referred with a prominent proptosis of the right eye in addition to external ophthalmoplegia. she had one year history of lacrimation. orbital computed tomography (ct) revealed an extraconal infiltration near the medial and inferior orbital wall consistent with orbit...
Ochoa (1944) showed that inorganic phosphate was esterified when a-ketoglutarate was oxidized to succinate by particulate preparations obtained from heart muscle. These particles have been identified with the sarcosomes, the granules in muscle which correspond to mitochondria in other tissues (Cleland & Slater, 1953a, b; see also Harman & Feigelson, 1952). A recent paper (Slater, 1953b) describ...
We theoretically study orbital alignment in x-ray-ionized atoms and ions, based on improved electronic-structure calculations starting from the Hartree-Fock-Slater model. employ first-order many-body perturbation theory to improve show that use of first-order-corrected energies yields significantly better transition than originally obtained. The enable us also compute individual state-to-state ...
Efficient method for localised functions using domain transformation and Fourier sine series" (2014). Taylor & Francis makes every effort to ensure the accuracy of all the information (the " Content ") contained in the publications on our platform. However, Taylor & Francis, our agents, and our licensors make no representations or warranties whatsoever as to the accuracy, completeness, or suita...
Internet Electronic Conference of Molecular Design 2003, November 23 – December 6 Abstract Motivation. Multi-center integrals are certainly the building blocks of quantum chemistry packages ranging from semi-empirical to the so-called ab-initio. The efficiency (accuracy and speed) of the numerical methods used for the computation of such integrals is therefore of extreme importance since millio...
A prototype three center exchange integral over Slater orbitals is reduced to an in nite series A closed expression is given for the general term The generalization to the orbitals of arbitrary quantum number is outlined The derivations and the production of this paper were mechanized Introduction The evaluation of the full range of molecular integrals over Slater orbitals ETOs remains an unsol...
This study aims to determine the condition factors influencing the in vitro proliferation culture of spermatogonial stem cells (SSCs) through isolation and culture of SSCs. With mouse embryonic fibroblast (MEF) cells, SIM-6-thiogunanie-oualiain (STO) cells and Hela cells used as the feeder layers, we compared the numbers of cell clones treated with mitomycin C as well as the proliferation condi...
greater than the bulk value, depending on the deposition temperature. There is no signifi cant change in density and cationic ratio of the oxide so the effect is attributed to Sr/Ti antisite defects, an attribution supported by density functional theory calculations. It was found that the bandgap enhancement signifi cantly changes the electronic and magnetic phases in the oxygen-vacancy-induced...
We present applications of the recently introduced “Generalized SIC-Slater” scheme which provides a simple Self-Interaction Correction approximation in the framework of the Optimized Effective Potential. We focus on the computation of static polarizabilities which are known to constitute stringent tests for Density Functional Theory. We apply the new method to model H4 chains, but also to more ...
نمودار تعداد نتایج جستجو در هر سال
با کلیک روی نمودار نتایج را به سال انتشار فیلتر کنید