نتایج جستجو برای: hydrogen' oft
تعداد نتایج: 148323 فیلتر نتایج به سال:
we optimized the geometries of the graphene and graphene with hydrogen using pw91vwn, pwcipl,mpwlyp, g96lyp, g96141.0-210.6-310, 6-31g*ievels of theory and compared our results with each other.we present the most important structural parameters determined for the addition of a hydrogen atom tographene and the outward movement of the carbon atom that is bonded to hydrogen is 0.48 a also wecalcul...
We optimized the geometries of the graphene and graphene with hydrogen using PW91VWN, PWCIPL,MPWLYP, G96LYP, G96141.0-210.6-310, 6-31G*Ievels of theory and compared our results with each other.We present the most important structural parameters determined for the addition of a hydrogen atom tographene and the outward movement of the carbon atom that is bonded to hydrogen is 0.48 A Also wecalcul...
abstract the influence of cation?? and anion?? interactions on the strength and nature of n…h hydrogen bond has been investigated by quantum chemical calculations in s-triazine…3hf complex. ab initio calculations were performed at mp2/6-311++g(d,p) level of theory. the natural bond orbital (nbo) analysis and the bader’s quantum theory of atoms in molecules (aim) were also used to elucidate t...
The research work carried out within the OFT-project shall provide insights, methods, and prototypic software to support the design of hydraulic closed loop control systems. The paper in hand presents an overview of the research work, motivates the current objectives of the project, and provides useful background information. In particular we develop different views of the hydraulic design proc...
The report by the Office of Fair Trading (OFT) on the UK pharmaceutical price regulation scheme (PPRS) recommends the reform of the current scheme, which is a combination of profit and price controls, to one where price is based on the health benefits offered by a pharmaceutical. On closer examination some of the more commonly expressed concerns about these proposals do not seem to be well foun...
Baekgrouund & purpose: Diagnosis of microcytic hgpochromia is rutinely done using automatied equipment cell counter which is expensive and requaires expert. Personal OFT can be used for this globular defect. The aim of this study is to determine the best NaCL con centration in OFT, the experiments were done at fajer lab in 2001. Material & methods: 696 Random patients were examined simulta...
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