ウメルウメール (umair umer) - マイポータル - researchmap

基本情報

所属: 北海道大学創成研究機構化学反応創成研究拠点創成研究機構化学反応創成研究拠点

学位: PhD(2024年9月 University of Chinese Academy of Sciences)

通称等の別名: UU
研究者番号: 21015456
ORCID iD: https://orcid.org/0000-0001-7778-2483
J-GLOBAL ID: 202401012585880659
researchmap会員ID: R000079390

研究キーワード

2

Chemical Reaction Dynamics for Complex System, Phase Space Geometry, Phase Space and Rovibronic Coupling
Quamtum Molecular Dynamics, Spectral Differenc Method, Theoretical amd Computational Chemistry, Chemical Reaction, Numerical Simulation of Chemical Reaction

研究分野

5

主要な経歴

4

2026年1月 - 現在

北海道大学創成研究機構化学反応創成研究拠点, 創成研究機構化学反応創成研究拠点

もっとみる

学歴

3

2016年9月 - 2024年9月

University of Chinese Academy of Sciences, State Key Laboratory of Reaction Molecular Dynamics and Center for Theoretical and Computational Chemistry, Dalian Insitute of Chemical Physics, Chinese Academy of Sciences
2010年10月 - 2012年3月

COMSATS University Islamabad, Pakistan, Department of Mathematics
2004年9月 - 2009年3月

COMSATS University Islamabad, Pakistan, Department of Mathematics

委員歴

1

2023年3月 - 2023年3月

iCOMET Reviewer Panel

受賞

6

2026年4月

Fursion startup 2026 Research Grant
2025年4月

Fusion Startup 2025 Research Grant, ICReDD, Hokkaido University
2024年12月

Postdoc Funding, ICReDD, Hokkaido University
2016年8月

UCAS Full Scholarship for PhD studies, University of Chinese Academy of Sciences
2010年9月

Graduate Scholarship, COMSATS University Islamabad
2004年9月

Full Fee Wavier for Undergradate Studies, COMSATS University Islamabad

論文

8

Burst buffer accelerated direct numerical simulation of turbulence generated by 3D sparse multiscale grids

Syed M. Usama, Nadeem A. Malik, Umair Umer, Amjad Shaikh, Zhigang Sun

Computers & Fluids 2026年3月
Integrating kinetic mechanism of novel benzimidazole derivatives as potential acetylcholinesterase inhibitors: Insight into in-vitro and in-silico approaches

Tariq, M., Hussain, R., Sardar, A., Rahim, F., Khan, S., Umer, U., Rehman, W., Khan, Y., Iqbal, T., Sarfraz, H. …

Journal of Molecular Structure 1348 2025年7月
Prominence of copper in AuCu alloy towards enhance surface plasmon resonance-driven water oxidation

Rida Shahzadi Haider, Shengyang Wang, Jianfeng Zhao, Yuxin Xie, Qi Ye, Yue Zhao, Umair Umer, Can Li

Nano Energy 133(9) 110499-110507 2025年1月31日査読有り
Product state-resolved reactive scattering calculations using stair shaped grids in hyperspherical coordinates for the quantum wave packet method

Umair Umer, Syed Muhammad Usama, Hailin Zhao, Zhigang Sun

Theoretical Chemistry Accounts 143(8) 2024年7月12日査読有り筆頭著者
A time-dependent quantum wavepacket method on stair-shaped grids for reactive scattering using the hyperspherical coordinates

Umair Umer, Syed Kazim Usman, Syed Muhammad Usama, Hailin Zhao, Zhigang Sun

Chemical Physics Letters 837 2024年2月査読有り筆頭著者
Correction: Umer et al. High Order Split Operators for the Time-Dependent Wavepacket method of Triatomic Reactive Scattering in Hyperspherical Coordinates. Entropy 2019, 21, 979

Umair Umer, Hailin Zhao, Syed Kazim Usman, Zhigang Sun

Entropy 24(11) 2022年10月26日
High Order Split Operators for the Time-Dependent Wavepacket method of Triatomic Reactive Scattering in Hyperspherical Coordinates

Umair Umer, Hailin Zhao, Syed Usman, Zhigang Sun

Entropy 21(10) 2019年10月8日査読有り筆頭著者
An interaction-asymptotic region decomposition method for general state-to-state reactive scatterings

Hailin Zhao, Umair Umer, Xixi Hu, Daiqian Xie, Zhigang Sun

The Journal of Chemical Physics 150 134105 2019年4月査読有り

書籍等出版物

1

A Finite Volume Scheme for Solving Coupled Continuous Preferential Crystallization Model

Umair Umer, Shams ul Qamar (担当:共著)

COMSATS University Islamabad 2012年3月

講演・口頭発表等

12

Accurate High-Order Derivatives of Chebyshev expanded PES for Phase-Space Chemical Dynamics

Umair Umer

4th LIST Symposium, Hokkaido University (2026) 2026年8月4日
Quantifying the Contribution of Nonreactive Modes to Reaction Dynamics in Phase Space: Analytical Prediction of the Passage Time τ near a Saddle Point

41st Symposium on Chemical Kinetics and Dynamics, Hokkaido University (2026) 2026年6月4日
Robust High-Order PES Derivatives from Chebyshev Polynomial Representations for Phase-Space Chemical Dynamics

Umair Umer

41st Symposium on Chemical Kinetics and Dynamics, Hokkaido University (2026) 2026年6月3日
Quantitative evaluation of the reaction contribution of non-reactive modes in phase space - Analysis and prediction of local residence time τ

Computational Physics Spring School, Okinawa 2026年3月11日
Reaction coordinate analysis in chemical reaction kinetics of real molecules using Lie canonical transformation perturbation theory

19th Symposium on Molecular Science 2025
Development of Variable Transformation Method for molecular quantum dynamics calculations

Umair Umer

Q. K. Ghori Alumni Seminar Series, SIAM Student Chapter 2025年7月22日招待有り
Efficient SS-APH method for product state-resolved information for reactive scattering

Umair Umer, S.K. Usman, S.M. Usama, Z. Sun

34th Annual Congress of the Chinese Chemical Society 2024年6月17日
An accurate and efficient Spectral DVR for Time Dependent Wavepacket method in Hyperspherical Coordinates

Umair Umer, Syed Kazim Usman, S.M Usama

one-day workshop on “Mathematics for Artificial Intelligence” held on September 28, 2020, at CUI Islamabad, Pakistan. 2020年9月28日
Spectral Element Method for Triatomic Reactive Scattering Problems in APH coordinates

Umair Umer, S.K Usman, Z. Sun

16th National Conference on Chemical Dynamics of the Chinese Chemical Society October 11-14, 2019, Suzhou City, Jiangsu Province, China. 2019年10月13日
Finite element DVR method for TDWP method for Triatomic Schrodinger Equation in Hyperspherical Coordinates

Umair Umer, SK Usman, Z. Sun

35th International Symposium for Free Radicals, Sep 15-20, 2019, Hangzhou, China. 2019年9月19日
Higher Order Split Operators in APH-coordinates

Umair Umer, Syed Kazim Usman, Z Sun

31st Annual Academic Meeting of the Chinese Chemical Society May 04-08, 2018, Hangzhou, Zhejiang Province, China. 2018年5月6日
Comparison study of Chebyshev and Split Operator Method in APH coordinate

Umair Umer, Z. Sun

15th National Conference on Chemical Dynamics of the Chinese Chemical SocietyAugust 11-14, 2017, Nanjing, Jiangsu Province, China. 2017年8月12日

所属学協会

1

2017年4月 - 2020年4月

Chinese Chemical Society

学術貢献活動

4

4th International Conference on Computing, Mathematics and Engineering Technologies

審査・評価

iCOMET 2023 March 17-18 held at Sukkur IBA University, Pakistan. 2023年3月17日 - 2023年3月18日
Symposium

企画立案・運営等

COMSATS Institute of Information Technology Abbottabad.
Faculty Development Program

その他

COMSATS headquarter Islamabad, Pakistan.
Reviewer in Journal of Scientific Research and Reports 2021

審査・評価

社会貢献活動

1

Islamabad student recounts teacher's ‘selfless act’ when earthquake struck

講師

https://tribune.com.pk/story/980557/islamabad-student-recounts-teachers-selfless-act-when-earthquake-struck