sesamoiditis
发表于 2025-3-21 17:09:23
书目名称Computational Methods for Large Molecules and Localized States in Solids影响因子(影响力)<br> http://impactfactor.cn/if/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids影响因子(影响力)学科排名<br> http://impactfactor.cn/ifr/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids网络公开度<br> http://impactfactor.cn/at/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids网络公开度学科排名<br> http://impactfactor.cn/atr/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids被引频次<br> http://impactfactor.cn/tc/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids被引频次学科排名<br> http://impactfactor.cn/tcr/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids年度引用<br> http://impactfactor.cn/ii/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids年度引用学科排名<br> http://impactfactor.cn/iir/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids读者反馈<br> http://impactfactor.cn/5y/?ISSN=BK0232726<br><br> <br><br>书目名称Computational Methods for Large Molecules and Localized States in Solids读者反馈学科排名<br> http://impactfactor.cn/5yr/?ISSN=BK0232726<br><br> <br><br>
appall
发表于 2025-3-21 22:52:08
Quantum Chemistry. Theory of Geometries and Energies of Small Moleculesuantum mechanical techniques. For the most part, such attempts have been based on molecular orbital techniques at various levels of approximation. In this paper, the current status of such theories for geometries and energies of small organic molecules will be reviewed.
appall
发表于 2025-3-22 03:32:18
Organic Transition Statescription of the pathway followed by the different atoms in the molecule (or molecules) during the reaction. One important feature of the pathway is the actual geometry of the col, or potential barrier: the so-called .. Transition states are not amenable to direct experimental observation; only indir
Acquired
发表于 2025-3-22 05:40:05
Solid State Concepts in Radiation Chemistry and Biologyiology are discussed from a solid state point of view. This realm, often referred to as the .. of radiation chemistry, occurs in the time range 10. < t < 10. sec, and its understanding is of paramount importance in the interpretation and prediction of channels for energy dissipation in radiation che
maudtin
发表于 2025-3-22 10:36:52
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hypnogram
发表于 2025-3-22 13:40:10
Introductory Remarksy are areas in which computational quantum chemistry has so far had relatively little impact. This is certainly not because there are not important questions to be answered. The area of interactions between molecules or parts of the same molecule, and rotational barriers in polymer molecules, could
hypnogram
发表于 2025-3-22 18:44:27
Approximations for Large-Molecule Calculationsates in solids. Such studies differ from those applicable to small molecules through the necessity of choosing methods which do not outstrip our computing capacities, and differ from conventional infinite-crystal studies through a lack of exploitable translational symmetry. The regime under consider
backdrop
发表于 2025-3-22 22:51:12
AB Initio Computation of Molecular Structures Through Configuration Interactional difficulties in the application of its theories and models. This is particularly true because it is concerned with interactions of atoms and molecules which by their very nature cannot be described concisely in a single coordinate system. Yet, these computational hurdles must be overcome if the s
忍耐
发表于 2025-3-23 05:19:57
Die inneren Grenzen der Biographieforschungl on the speakers. However, I will take a little time to review some aspects of past history, plus a few pointers toward the future. (In this written account, I am taking the liberty of “extending” the brief remarks which I actually made).
绑架
发表于 2025-3-23 08:11:14
Narrative Identitätsarbeit im Interviewuantum mechanical techniques. For the most part, such attempts have been based on molecular orbital techniques at various levels of approximation. In this paper, the current status of such theories for geometries and energies of small organic molecules will be reviewed.