المؤلفون: Qiang Zhao, Zhengxue Ren, Pengwei Zhao, Tae-Sun Park

المصدر: Physics Letters B, Vol 841, Iss , Pp 137913- (2023)

مصطلحات موضوعية: Orbital-dependent relativistic density functional theory, Exchange energy functional, Relativistic optimized effective potential method, Relativistic Hartree-Fock approach, Physics, QC1-999

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S0370269323002472; https://doaj.org/toc/0370-2693

URL الوصول: https://doaj.org/article/a5c39590176d429dbe11884d903c44ae

المؤلفون: Singh, Aditi, Kumar, Vignesh Balaji, Grabowski, Ireneusz, Śmiga, Szymon

مصطلحات موضوعية: Optimised Effective Potential Method, Singular Value Decomposition, Regularization, Kohn-Sham Density Functional Theory, OEP, Finite basis Set Implementation, OEPx, OEP-GL2

Relation: Advances in Quantum Chemistry;vol. 87; Musiał Monika, Grabowski Ireneusz (red.): Polish Quantum Chemistry from Kołos to Now, 2023, pp. 297-317; https://doi.org/10.1016/bs.aiq.2023.01.003; http://repozytorium.umk.pl/handle/item/6917

الاتاحة: http://repozytorium.umk.pl/handle/item/6917
https://doi.org/10.1016/bs.aiq.2023.01.003

المؤلفون: Sharma, S., Dewhurst, J.K., Ambrosch-Draxl, C., Kurth, S., Helbig, N., Pittalis, S., Shallcross, Sam, Nordstrom, L., Gross, E.K.U.

المصدر: Sharma , S , Dewhurst , J K , Ambrosch-Draxl , C , Kurth , S , Helbig , N , Pittalis , S , Shallcross , S , Nordstrom , L & Gross , E K U 2007 , ' First-principles approach to noncollinear magnetism: Towards spin dynamics ' , Physical Review Letters , vol. 98 , no. 19 , pp. 196405 . https://doi.org/10.1103/PhysRevLett.98.196405

مصطلحات موضوعية: FLUCTUATIONS, DENSITY-FUNCTIONAL THEORY, SOLIDS, FE, EFFECTIVE-POTENTIAL METHOD, FINITE-TEMPERATURE, EXACT EXCHANGE

وصف الملف: application/pdf

Relation: https://orbit.dtu.dk/en/publications/bfefc7eb-c8e9-4e64-97ac-20cbb230c0d6

الاتاحة: https://orbit.dtu.dk/en/publications/bfefc7eb-c8e9-4e64-97ac-20cbb230c0d6
https://doi.org/10.1103/PhysRevLett.98.196405
https://backend.orbit.dtu.dk/ws/files/4794091/Sharma.pdf
http://link.aps.org/doi/10.1103/PhysRevLett.98.196405

المؤلفون: Ireneusz Grabowski, Adam Buksztel, Fabio Della Sala, Szymon Śmiga, Eduardo Fabiano

المصدر: Journal of computational chemistry (Online) (2016): 2081–2090. doi:10.1002/jcc.24436
info:cnr-pdr/source/autori:S. Smiga, F. Della Sala, A. Buksztel, I. Grabowski, and E. Fabiano/titolo:Accurate Kohn-Sham ionization potentials from scaled-opposite-spin second-order optimized effective potential methods/doi:10.1002%2Fjcc.24436/rivista:Journal of computational chemistry (Online)/anno:2016/pagina_da:2081/pagina_a:2090/intervallo_pagine:2081–2090/volume

مصطلحات موضوعية: Physics, 010304 chemical physics, Reference data (financial markets), Kohn–Sham equations, Context (language use), General Chemistry, 01 natural sciences, Computational Mathematics, Quality (physics), Computational chemistry, Ionization, Quantum mechanics, 0103 physical sciences, Physics::Atomic and Molecular Clusters, ionization potential, spin component scaled method, Density functional theory, Ionization energy, 010306 general physics, optimized effective potential method, Spin-½

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::521367f43db199b424d15a972acb2b96
https://pubmed.ncbi.nlm.nih.gov/27357413

المؤلفون: Zhu, Shufang, Wei, Kangliang, Du, Gang, Liu, Xiaoyan

المساهمون: Zhu, SF (reprint author), Peking Univ, Inst Microelect, Beijing 100871, Peoples R China., Peking Univ, Inst Microelect, Beijing 100871, Peoples R China.

المصدر: EI ; SCI

مصطلحات موضوعية: effective potential method, Gate-All-Around mosfet, Germanium, Nanowire, 3D full band Monte Carlo simulation

Relation: 2011 INTERNATIONAL CONFERENCE OF ELECTRON DEVICES AND SOLID-STATE CIRCUITS (EDSSC).; 1056207; http://hdl.handle.net/20.500.11897/292925; WOS:000304037500142

الاتاحة: https://hdl.handle.net/20.500.11897/292925
https://doi.org/10.1109/EDSSC.2011.6117723

المؤلفون: 方民权, 张卫民, 张理论, 曾琅, 刘晓彦, 尹龙祥

المساهمون: 国防科学技术大学计算机学院,湖南长沙,410073, 国防科学技术大学计算机学院,湖南长沙410073, 国家超级计算广州中心,广东广州510006, 北京航空航天大学电子信息工程学院,北京100091, 北京航空航天大学自旋电子交叉研究中心,北京100091, 北京大学微纳电子学研究院,北京,100871

المصدر: 知网 ; 万方 ; CSCD ; http://d.g.wanfangdata.com.cn/Periodical_jsjgcykx201504001.aspx

مصطلحات موضوعية: 蒙特卡罗, 半导体器件模拟, 集成众核, 有效电势方法, 粒子自由飞行, Monte Carlo, device simulating for semiconductor, many integrated core, effective potential method, particle free flight

Relation: 计算机工程与科学.2015,37,(4),621-627.; 1287674; http://hdl.handle.net/20.500.11897/415316

الاتاحة: https://hdl.handle.net/20.500.11897/415316
https://doi.org/10.3969/j.issn.1007-130X.2015.04.001

المؤلفون: Kim, J Kim, Jaewook, Hong, K Hong, Kwangwoo, Choi, SH Choi, Sunghwan, Kim, WY Kim, Woo Youn

مصطلحات موضوعية: DENSITY-FUNCTIONAL THEORY, MULTIREFERENCE CONFIGURATION-INTERACTION, MULTIDETERMINANTAL WAVE-FUNCTIONS, MOLECULAR-EXCITATION ENERGIES, SELF-INTERACTION CORRECTION, EFFECTIVE-POTENTIAL METHOD, SINGLE-ELECTRON BASIS, CAS-DFT, STATES, COMBINATION

الاتاحة: http://hdl.handle.net/10203/198702
https://doi.org/10.1002/bkcs.10189

المؤلفون: Zhu, Shufang, Wei, Kangliang, Du, Gang, Liu, Xiaoyan

المساهمون: Du, G (reprint author), Peking Univ, Inst Microelect, Beijing 100871, Peoples R China., Peking Univ, Inst Microelect, Beijing 100871, Peoples R China.

المصدر: SCI ; EI

مصطلحات موضوعية: 3D full band Monte Carlo simulation, effective potential method, Gate-All-Around

Relation: JOURNAL OF CIRCUITS SYSTEMS AND COMPUTERS.2013,22,(10,SI).; 806407; http://hdl.handle.net/20.500.11897/291689; WOS:000209245200005

الاتاحة: https://hdl.handle.net/20.500.11897/291689
https://doi.org/10.1142/S0218126613400239

المؤلفون: Eduardo Fabiano, Andrew M. Teale, Fabio Della Sala, Adam Buksztel, Ireneusz Grabowski, Szymon Śmiga

المصدر: Molecular physics (Online) 112 (2014): 700–710. doi:10.1080/00268976.2013.854424
info:cnr-pdr/source/autori:I. Grabowski, A. M. Teale, E. Fabiano, S. ?miga, A. Buksztel, F. Della Sala/titolo:A density difference based analysis of orbital-dependent exchange-correlation functionals/doi:10.1080%2F00268976.2013.854424/rivista:Molecular physics (Online)/anno:2014/pagina_da:700/pagina_a:710/intervallo_pagine:700–710/volume:112
Molecular Physics

مصطلحات موضوعية: Biophysics, Ab initio, FOS: Physical sciences, chemistry.chemical_element, electron correlation, 01 natural sciences, Neon, localised Hartree-Fock, Physics - Chemical Physics, 0103 physical sciences, Physics::Atomic and Molecular Clusters, ab initio DFT, Physical and Theoretical Chemistry, 010306 general physics, Wave function, Molecular Biology, density functional theory, Chemical Physics (physics.chem-ph), Physics, Condensed Matter - Materials Science, 010304 chemical physics, Series (mathematics), Electronic correlation, Materials Science (cond-mat.mtrl-sci), Condensed Matter Physics, optimised effective potential method, Specific orbital energy, chemistry, Density functional theory, Atomic physics, Ground state

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::53c116c68019ac376bf17f1c0f1bd7a0
http://www.tandfonline.com/doi/full/10.1080/00268976.2013.854424#.UzPlZWfmQWM

المساهمون: Robinson, E

المصدر: Phys. Rev., 182: 196-200(June 5, 1969).; Other Information: Orig. Receipt Date: 31-DEC-69

وصف الملف: Medium: X

URL الوصول: http://www.osti.gov/scitech/biblio/4802666

المساهمون: Taksar, I

المصدر: Opt. Spectrosc. (USSR) (Engl. Transl.), 23: 191-2(Sept. 1967).; Other Information: Orig. Receipt Date: 31-DEC-68; Other Information: Translated from Opt. Spektrosk., 23: 353-6(Sept. 1967).

وصف الملف: Medium: X

URL الوصول: http://www.osti.gov/scitech/biblio/4572043

المساهمون: Popov, V

المصدر: Yadern. Fiz. 14: No. 2, 458-68(Aug 1971).; Other Information: Orig. Receipt Date: 31-DEC-72

وصف الملف: Medium: X

URL الوصول: http://www.osti.gov/scitech/biblio/4731433

المساهمون: Everett, A

المصدر: Phys. Rev., D 5: No. 7, 1681-5(1 Apr 1972).; Other Information: Orig. Receipt Date: 31-DEC-72

وصف الملف: Medium: X

URL الوصول: http://www.osti.gov/scitech/biblio/4639489