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K

Koblar Alan Jackson

University of Texas at El Paso

41H指数
297论文数
4.4W被引数
收录论文 63
发表时间
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Assessing Self-Interaction Corrections in the Selective Catalytic Reduction of NO on a Cu-SSZ-13 Zeolite Cluster Model评估NO选择性催化还原中Cu-SSZ-13沸石团簇模型的自我相互作用校正
errJournal of Physical Chemistry A
IF2.8
err2026-07-30
err0
PREAI
errPriyanka B. Shukla; Selim Romero; Tunna Baruah; Rajendra R. Zope; Koblar A. Jackson; J. Karl Johnson
err分享
err收藏
Local Spin Density Approximation Strongly Improved by a Better-Informed Local Scaling of Its Self-Interaction Correction通过更完善的局部标度改进其自相互作用校正的局域自旋密度近似
errJournal of Chemical Theory and Computation
IF5.5
err2026-05-29
err0
errOAAI
errChandra Shahi; Rohan Maniar; Jinliang Ning; Raj K. Sah; Mark R. Pederson; Adrienn Ruzsinszky; Juan E. Peralta; Koblar A. Jackson; John P. Perdew
err分享
err收藏
Noniterative Fermi-Lowdin Orbitals for Self-Interaction Correction非迭代Fermi-Lowdin轨道用于自相互作用修正
errJournal of Physical Chemistry A
IF2.8
err2026-02-01
err0
errOAAI
errPeralta, Juan E.; Jackson, Koblar A.; Pederson, Mark R.; Melo, Juan I.; Alcoba, Diego R.; Massaccesi, Gustavo E.; Lain, Luis; Torre, Alicia; Ona, Ofelia B.
err分享
err收藏
Editorial: DCOMP's 2025 Rahman and Metropolis Awards编辑：DCOMP的2025年拉赫曼与梅特罗波利斯奖
errPHYSICAL REVIEW E
IF2.4
err2025-09-25
err0
PREAI
errJackson, Koblar Alan; Schleife, Andre
err分享
err收藏
Atomic ionization: sd energy imbalance and Perdew-Zunger self-interaction correction energy penalty in 3d atoms原子电离：3d原子中的sd能量不平衡和Perdew-Zunger自相互作用校正能量惩罚
errPROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
IF9.1
err2025-03-07
err0
errOAAI
errManiar, Rohan; Shukla, Priyanka B.; Johnson, J. Karl; Jackson, Koblar A.; Perdew, John P.
err分享
err收藏
Electronic structure simulations in the cloud computing environment云计算环境下的电子结构模拟
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-10-21
err1
errOAAI
errBylaska, Eric J.; Panyala, Ajay; Bauman, Nicholas P.; Peng, Bo; Pathak, Himadri; Mejia-Rodriguez, Daniel; Govind, Niranjan; Williams-Young, David B.; Apra, Edoardo; Bagusetty, Abhishek; Mutlu, Erdal; Jackson, Koblar A.; Baruah, Tunna; Yamamoto, Yoh; Pederson, Mark R.; Withanage, Kushantha P. K.; Pedroza-Montero, Jesus N.; Bilbrey, Jenna A.; Choudhury, Sutanay; Firoz, Jesun; Herman, Kristina M.; Xantheas, Sotiris S.; Rigor, Paul; Vila, Fernando D.; Rehr, John J.; Fung, Mimi; Grofe, Adam; Johnston, Conrad; Baker, Nathan; Kaneko, Ken; Liu, Hongbin; Kowalski, Karol
err分享
err收藏
Hyperfine interactions for small systems including transition-metal elements using self-interaction corrected density-functional theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-07-01
err0
PREAI
errKaranovich, Anri; Jackson, Koblar Alan; Park, Kyungwha
err分享
err收藏
The rise and fall of stretched bond errors: Extending the analysis of Perdew-Zunger self-interaction corrections of reaction barrier heights beyond the LSDA
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-03-25
err2
errOAAI
errSingh, Yashpal; Peralta, Juan E.; Jackson, Koblar A.
err分享
err收藏
Bond length alternation of π-conjugated polymers predicted by the Fermi-Lowdin orbital self-interaction correction method
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-01-02
err1
PREAI
errNguyen, Duyen B.; Jackson, Koblar A.; Peralta, Juan E.
err分享
err收藏
Use of FLOSIC for understanding anion-solvent interactions
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-10-20
err6
errOAAI
errPederson, Mark R.; Withanage, Kushantha P. K.; Hooshmand, Zahra; Johnson, Alex I.; Baruah, Tunna; Yamamoto, Yoh; Zope, Rajendra R.; Kao, Der-You; Shukla, Priyanka B.; Johnson, J. Karl; Peralta, Juan E.; Jackson, Koblar A.
err分享
err收藏
Downward quantum learning from element 118: Automated generation of Fermi-Lowdin orbitals for all atoms
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-02-22
err6
errOAAI
errPederson, Mark R.; Johnson, Alexander I.; Withanage, Kushantha P. K.; Dolma, Sherab; Flores, Gustavo Bravo; Hooshmand, Zahra; Khandal, Kusal; Lasode, Peter O.; Baruah, Tunna; Jackson, Koblar A.
err分享
err收藏
Spin-crossover complexes: Self-interaction correction vs density correction
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-02-08
err5
errOAAI
errRuan, Shiqi; Jackson, Koblar A.; Ruzsinszky, Adrienn
err分享
err收藏
Complex Fermi-Lowdin orbital self-interaction correction
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-06-17
err6
errOAAI
errWithanage, Kushantha P. K.; Jackson, Koblar A.; Pederson, Mark R.
err分享
err收藏
Fermi-Lowdin orbital self-interaction correction of adsorption energies on transition metal ions
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-04-01
err3
errOAAI
errWithanage, Kushantha P. K.; Sharkas, Kamal; Johnson, J. Karl; Perdew, John P.; Peralta, Juan E.; Jackson, Koblar A.
err分享
err收藏
Study of self-interaction-errors in barrier heights using locally scaled and Perdew-Zunger self-interaction methods
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-01-06
err17
errOAAI
errMishra, Prakash; Yamamoto, Yoh; Johnson, J. Karl; Jackson, Koblar A.; Zope, Rajendra R.; Baruah, Tunna
err分享
err收藏
Interlayer polarizability in twisted bilayer graphene quantum dots
errPHYSICAL REVIEW B
IF3.7
err2021-10-07
err7
PREAI
errWang, Xian; Zhang, Li; Yu, Shengping; Yang, Mingli; Jackson, Koblar Alan
err分享
err收藏
Electronic structure of mononuclear Cu-based molecule from density-functional theory with self-interaction correction
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-07-06
err14
errOAAI
errKaranovich, Anri; Yamamoto, Yoh; Jackson, Koblar Alan; Park, Kyungwha
err分享
err收藏
Self-interaction correction in water-ion clusters
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-03-02
err25
errOAAI
errWagle, Kamal; Santra, Biswajit; Bhattarai, Puskar; Shahi, Chandra; Pederson, Mark R.; Jackson, Koblar A.; Perdew, John P.
err分享
err收藏
Exploring and enhancing the accuracy of interior-scaled Perdew-Zunger self-interaction correction探索并提高内部比例perdew-zunger自相互作用校正的准确性
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-03-01
err17
errOAAI
errBhattarai, Puskar; Santra, Biswajit; Wagle, Kamal; Yamamoto, Yoh; Zope, Rajendra R.; Ruzsinszky, Adrienn; Jackson, Koblar A.; Perdew, John P.
err分享
err收藏
Density-related properties from self-interaction corrected density functional theory calculations
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-01-08
err12
errOAAI
errWithanage, Kushantha P. K.; Bhattarai, Puskar; Peralta, Juan E.; Zope, Rajendra R.; Baruah, Tunna; Perdew, John P.; Jackson, Koblar A.
err分享
err收藏

研究方向

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