From Benchmarking Molecular DMRG Investigations to Theoretical Modelling of New Singlet Fission Molecules

Author(s):  
Rajat Walia ◽  
Jun Yang
1994 ◽  
Vol 144 ◽  
pp. 1-9
Author(s):  
A. H. Gabriel

The development of the physics of the solar atmosphere during the last 50 years has been greatly influenced by the increasing capability of observations made from space. Access to images and spectra of the hotter plasma in the UV, XUV and X-ray regions provided a major advance over the few coronal forbidden lines seen in the visible and enabled the cooler chromospheric and photospheric plasma to be seen in its proper perspective, as part of a total system. In this way space observations have stimulated new and important advances, not only in space but also in ground-based observations and theoretical modelling, so that today we find a well-balanced harmony between the three techniques.


1992 ◽  
Vol 139 (5) ◽  
pp. 353 ◽  
Author(s):  
J. Pelayo ◽  
J. Paniello ◽  
N. Gisin ◽  
J.W. Burgmeijer ◽  
M. Blondel ◽  
...  

2020 ◽  
Author(s):  
Ekadashi Pradhan ◽  
Jordan N. Bentley ◽  
Christopher B. Caputo ◽  
Tao Zeng

This is a computational chemistry study in designing singlet fission chromophores based on a diazadiborine framework. Substitutions and additions are proposed to enhance diradical character of the diazadiborine so that the designed molecules satisfy the two energy criteria for singlet fission. Synthesizability of the designed molecules is discussed.


2019 ◽  
Author(s):  
Alexandr Zaykov ◽  
Josef Michl ◽  
Zdeněk Havlas ◽  
Eric Buchanan ◽  
Milena Jovanović
Keyword(s):  

Impact ◽  
2019 ◽  
Vol 2019 (10) ◽  
pp. 84-86
Author(s):  
Keisuke Fujii

The coordination and movement of people in large crowds, during sports games or when socialising, seems readily explicable. Sometimes this occurs according to specific rules or instructions such as in a sport or game, at other times the motivations for movement may be more focused around an individual's needs or fears. Over the last decade, the computational ability to identify and track a given individual in video footage has increased. The conventional methods of how data is gathered and interpreted in biology rely on fitting statistical results to particular models or hypotheses. However, data from tracking movements in social groups or team sports are so complex as they cannot easily analyse the vast amounts of information and highly varied patterns. The author is an expert in human behaviour and machine learning who is based at the Graduate School of Informatics at Nagoya University. His challenge is to bridge the gap between rule-based theoretical modelling and data-driven modelling. He is employing machine learning techniques to attempt to solve this problem, as a visiting scientist in RIKEN Center for Advanced Intelligence Project.


2018 ◽  
Vol 938 (8) ◽  
pp. 12-19
Author(s):  
S. B. Verdiyev

The possibility to use multi-wavelength regime of total stations operation for making surveys under heavy aerosol atmosphere pollution is researched. The actuality of single- and multi-wavelength regimes rational choice under heavy aerosol atmosphere pollution is grounded. The task on researching the matter of operational regime choice for total stations is formulated. The method for solution of the formulated task is suggested. The theoretical modelling and experimental researches are held to formulate the criterion for choice of single- or multi-wavelength regimes. The practical recommendations for such a choice are formulated. The practical recommendations are formulated for choice of measurements regime. According to formulated recommendations if a single-wavelength total station operates in the field of longer wavelengths (R) of visible band and a three-wavelengths one operates with bias to shorter (B, G, R) wavelengths, the single-wavelength total station should be preferred. But if the single-wavelength total station operates in the field of shorter wavelengths (B) and the three-wavelengths one operates with bias to longer wavelengths (B, G, R) then the multi-wavelengths total station should be preferred. The recommendation described in this article are relevant for both the regimes of measurements with- and without reflector and can be useful for users of total stations.


2020 ◽  
Vol 45 (49) ◽  
pp. 26321-26333
Author(s):  
Israel González ◽  
Francisco De Santiago ◽  
Lucía G. Arellano ◽  
Álvaro Miranda ◽  
Alejandro Trejo ◽  
...  

2015 ◽  
Vol 6 (1) ◽  
Author(s):  
Rui Wang ◽  
Chunfeng Zhang ◽  
Bo Zhang ◽  
Yunlong Liu ◽  
Xiaoyong Wang ◽  
...  

Author(s):  
Xingang Zhao ◽  
James P. O’Connor ◽  
Jonathan D. Schultz ◽  
Youn Jue Bae ◽  
Chenjian Lin ◽  
...  

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