WorldCat Identities

Yang, Weitao

Overview
Works: 22 works in 68 publications in 3 languages and 2,270 library holdings
Roles: Editor, Other, Author, Contributor
Publication Timeline
.
Most widely held works by Weitao Yang
Density-functional theory of atoms and molecules by Robert G Parr( )

32 editions published between 1989 and 2015 in English and held by 1,960 WorldCat member libraries worldwide

This book is a rigorous, unified account of the fundamental principles of the density-functional theory of the electronic structure of matter and its applications to atoms and molecules. Containing a detailed discussion of the chemical potential and its derivatives, it provides an understanding of the concepts of electronegativity, hardness and softness, and chemical reactivity. Both the Hohenberg-Kohn-Sham and the Levy-Lieb derivations of the basic theorems are presented, and extensive references to the literature are included. Two introductory chapters and several appendices provide all the background material necessary beyond a knowledge of elementary quantum theory
Guosen Yan : a festschrift from theoretical chemistry accounts by Hua Guo( )

9 editions published between 2015 and 2016 in English and held by 277 WorldCat member libraries worldwide

"In this Festschrift dedicated to the 85th birthday of Professor Guosen Yan, selected researchers in theoretical chemistry present research highlights on major developments in the field. Originally published in the journal Theoretical Chemistry Accounts, these outstanding contributions are now available in a hardcover print format, as well as a special electronic edition. This volume provides valuable content for all researchers in theoretical chemistry, and will especially benefit those research groups and libraries with limited access to the journal"--Back cover
Symposium on Density Functional Theory and Applications by Durham, NC> Symposium on Density Functional Theory and Applications <1997( Book )

6 editions published in 1998 in English and held by 8 WorldCat member libraries worldwide

Genshi bunshi no mitsudo hankansūhō( Book )

2 editions published in 1996 in Japanese and held by 5 WorldCat member libraries worldwide

Symposium on Density Functional Theory and Applications by Symposium on Density Functional Theory and Applications( Book )

2 editions published in 1998 in English and held by 2 WorldCat member libraries worldwide

Studies in density functional theory : chemical reactivity, kinetic energy by Weitao Yang( )

1 edition published in 1986 in English and held by 2 WorldCat member libraries worldwide

Wo xiang zhi dao zen me ban by Ling Wang( Book )

1 edition published in 2004 in Chinese and held by 1 WorldCat member library worldwide

Sculpting Molecular Potentials to Design Optimized Materials: The Inverse Design of New Molecular Structures( )

1 edition published in 2010 in English and held by 1 WorldCat member library worldwide

The aim of this project was to develop inverse design methods capable of designing optimized molecular species and materials. The project involved the development of continuous, integer, and hybrid molecular optimization methods that allow the identification of optimal target species. A component of this project involves the synthesis and characterization of these candidate materials. The target property in this project is the nonlinear optical response of organic species. The outcome of this project was a suite of methods useful for the design and optimization of molecular materials
Wo xiang zhi dao ta shi shei by Ling Wang( Book )

1 edition published in 2004 in Chinese and held by 1 WorldCat member library worldwide

Lun dao de zi wo de jia zhi shi xian( Book )

1 edition published in 2013 in Chinese and held by 1 WorldCat member library worldwide

Accurate atomic quantum defects from particle-particle random phase approximation( )

1 edition published in 2016 in English and held by 1 WorldCat member library worldwide

ABSTRACT: The accuracy of calculations of atomic Rydberg excitations cannot be judged by the usual measures, such as mean unsigned errors of many transitions. We show how to use quantum defect (QD) theory to (a) separate errors due to approximate ionisation potentials, (b) extract smooth QDs to compare with experiment, and (c) quantify those defects with a few characteristic parameters. The particle-particle random phase approximation (pp-RPA) produces excellent Rydberg transitions that are an order of magnitude more accurate than those of time-dependent density functional theory with standard approximations. We even extract reasonably accurate defects from the lithium Rydberg series, despite the reference being open-shell. Our methodology can be applied to any Rydberg series of excitations with four transitions or more to extract the underlying threshold energy and characteristic QD parameters. Our pp-RPA results set a demanding challenge for other excitation methods to match. Abstract
Density functional theory and applications : Proceedings by Symposium on Density Functional Theory and Applications( Book )

1 edition published in 1998 in English and held by 1 WorldCat member library worldwide

Special issue: Symposium on Density Functional Theory and Applications by Symposium on Density Functional Theory and Applications( Book )

in English and held by 1 WorldCat member library worldwide

Nanomaterials in Neural‐Stem‐Cell‐Mediated Regenerative Medicine: Imaging and Treatment of Neurological Diseases( )

1 edition published in 2018 in English and held by 1 WorldCat member library worldwide

Abstract: Patients are increasingly being diagnosed with neuropathic diseases, but are rarely cured because of the loss of neurons in damaged tissues. This situation creates an urgent clinical need to develop alternative treatment strategies for effective repair and regeneration of injured or diseased tissues. Neural stem cells (NSCs), highly pluripotent cells with the ability of self‐renewal and potential for multidirectional differentiation, provide a promising solution to meet this demand. However, some serious challenges remaining to be addressed are the regulation of implanted NSCs, tracking their fate, monitoring their interaction with and responsiveness to the tissue environment, and evaluating their treatment efficacy. Nanomaterials have been envisioned as innovative components to further empower the field of NSC‐based regenerative medicine, because their unique physicochemical characteristics provide unparalleled solutions to the imaging and treatment of diseases. By building on the advantages of nanomaterials, tremendous efforts have been devoted to facilitate research into the clinical translation of NSC‐based therapy. Here, recent work on emerging nanomaterials is highlighted and their performance in the imaging and treatment of neurological diseases is evaluated, comparing the strengths and weaknesses of various imaging modalities currently used. The underlying mechanisms of therapeutic efficacy are discussed, and future research directions are suggested. Abstract : The combination of neural stem cells (NSCs) and nanomaterials has great potential to facilitate NSC‐mediated therapeutics. They have already begun to provide unparalleled solutions to understanding tissue‐renovation mechanisms, and therefore allow the fate of NSCs to be controlled and tissue regeneration to be further guided, with the ultimate goal of creating nanomaterial‐involved NSC‐mediated therapeutics for personalized tissue‐regenerative medicine
Density-Functional Theory of Atoms and Molecules. International Series of Monographs on Chemistry( )

1 edition published in 1989 in English and held by 1 WorldCat member library worldwide

This book is a rigorous, unified account of the fundamental principles of the density-functional theory of the electronic structure of matter and its applications to atoms and molecules. Containing a detailed discussion of the chemical potential and its derivatives, it provides an understanding of the concepts of electronegativity, hardness and softness, and chemical reactivity. Both the Hohenberg-Kohn-Sham and the Levy-Lieb derivations of the basic theorems are included. Two introductory chapters and several appendices provide all the background material necessary beyond a knowledge of elementary quantum theory. The book is intended for physicists, chemists and advanced students in chemistry
Wo xiang zhi dao wei shi me by Ling Wang( Book )

1 edition published in 2004 in Chinese and held by 1 WorldCat member library worldwide

Density-Functional Study of the Geometries, Stabilities, and Bond Energies of III-V (13-15) Four-Membered Ring Compounds( )

1 edition published in 1996 in English and held by 1 WorldCat member library worldwide

A theoretical investigation has been carried out on several group III-V (13-15) four-membered ring compounds which, if experimentally attainable, are potentially useful as precursors to nanocrystalline electronic and semiconductor materials. Four-membered ring compounds considered in this study have core structures of the form: MEM'E'(top bracket) and MEMX(top bracket) (M, M' = In, Ga, Al; E, E' = P, As; X = Cl, Br). Equilibrium geometries, binding energies, and bond energies were determined based on local density approximation (LDA) and gradient-corrected density-functional methods. Optimized ring geometries obtained with LDA agree closely with single crystal X-ray crystallographic structures of known compounds with the same four-membered ring cores. The following trends in bond energies are observed: M-Cl>> M-P> M-As>> M-Br (M = In, Ga, Al), and Al-Y> Ga-Y> In-Y (Y = P, As, Cl, Br). Although only one M-Br-containing mixed-bridge four-membered ring compound has been reported and no such Al-Cl-containing mixed-bridge species have yet been synthesized, our calculations suggest that compounds containing these two ring systems are stable
Single event effects sensitivity of low energy proton in Xilinx Zynq-7010 system-on chip( )

1 edition published in 2017 in English and held by 1 WorldCat member library worldwide

Abstract: In this paper, experimental methods are emphatically described for measuring the proton single event effects (SEE) in Xilinx Zynq-7010 system-on chip. Experimental data are presented showing that low energy (3 MeV ≤ Energy ≤ 10 MeV) proton irradiation can cause single event effects in different hardware blocks of Xilinx Zynq-7010 SoC, including D-Cache, programmable logic (PL), arithmetic logical unit (ALU), float point unit (FPU) and direct memory access (DMA). Moreover, the sensitivities of different hardware blocks to single event effects are different. Finally, the Stopping and Range of Ions in Matter (SRIM) software calculations show the possible reasons for this difference. Highlights: Investigate the single event effects sensitivity of Xilinx Zynq-7010 SoC by the low-energy protons Describes the dynamic testing methods for different blocks of Zynq-7010 SoC in detail Obtain the SEE cross section curve for different energy protons
Robert G. Parr (1921-2017)( )

1 edition published in 2017 in English and held by 1 WorldCat member library worldwide

 
moreShow More Titles
fewerShow Fewer Titles
Audience Level
0
Audience Level
1
  Kids General Special  
Audience level: 0.18 (from 0.12 for Density-fu ... to 0.99 for Density-Fu ...)

Density-functional theory of atoms and molecules
Covers
Alternative Names
W.ヤング.

Weitao Yang.

ヤング, W.

Languages