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Journal of Physical Chemistry A 封面图

Journal of Physical Chemistry A

IF2.8
论文数1005
被引数60459
期刊论文 1005
发表时间
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A Chemical Space Perspective on Diastereomeric Barriers in Alkylperoxy-to-Hydroperoxyalkyl Isomerization从化学空间角度探讨烷氧基过氧到氢过氧烷基异构化的立体异构体势垒
deleteJournal of Physical Chemistry A
IF2.8
delete2026-09-17
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PREAI
deleteRaghunathan Ramakrishnan
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Observations-Based Approach to the Estimation of the Oxidizing Capacity of the Atmosphere of Central London over the 2000–2024 Period基于观测的方法评估2000–2024年期间伦敦市中心的氧化容量
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IF2.8
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deleteM. Anwar H. Khan; Richard G. Derwent; Frank A. F. Winiberg; Carl J. Percival; Dudley E. Shallcross
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Unraveling the Catalytic Role of Metal- and Halide-Free Phosphonium Systems in CO2 Transformation揭示无金属和卤素磷鎓体系在二氧化碳转化中的催化作用
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IF2.8
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deleteAhmed G. B. Hofny; Ashour A. Ahmed; Fatma S. M. Hassan; M. A. El Taher; Morad M. El-Hendawy
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IR Spectroscopy of Gas-Phase Protonated Water–Acetonitrile Clusters: Comparison of the Clusters in the Condensed Phase and Gas Phase气相质子化水-乙腈簇的IR光谱：凝聚相和气相中簇的比较
deleteJournal of Physical Chemistry A
IF2.8
delete2026-09-17
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deleteKohei Chiba; Asuka Fujii
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The Vibrational Raman Optical Activity of β-Propiolactone Derivatives Computed with Coupled-Cluster Theoryβ-丙炔酸内酯衍生物的振动拉曼光学活性基于耦合簇理论计算
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IF2.8
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deleteMya S. Pederson; Luther D. Crum; Ethan J. Poncelet; Brendan M. Shumberger; T. Daniel Crawford; Rollin A. King
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Effect of Multistructural Anharmonicity and Tunneling on H Abstraction from Propanal by H, OH, CH3, and C2H5多结构非谐性和隧穿效应对H, OH, CH3和C2H5从丙醛中提取H的影响
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IF2.8
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deleteXue Zou; Jiuning He; Rong Chen; Jianhua Li; Xingzhi Wang; Lei Chen; Changhua Zhang; Deliang Chen
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Transient Absorption Spectroscopy of the Stilbenes in Methanol─Adiabatic cis→ trans Photoisomerization by Sequential Two-Photon Excitation甲苯中 Stilbenes 的瞬态吸收光谱学─通过顺序双光子激发实现的绝热顺反光异构化
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deleteSumesh B. Krishnan; Joseph Sundar Raaj Vellore Winfred; Edwin F. Hilinski; Jack Saltiel; László Zimányi
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Polarizable Split-Charge Equilibration for Accurate Modeling of Nonbonded Interactions可极化分裂电荷平衡以准确建模非键相互作用
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deleteTaehwan Jang; Minho M. Kim; Hoon Ryu; William A. Goddard, III; Hyungjun Kim
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KiMecO: A Kinetic Mechanism Optimizer for Experimentally Constrained Master Equation ModelsKiMecO：一种用于实验约束主方程模型的动力学机理优化器
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deleteClément Soulié; Judit Zádor; Leonid Sheps
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Chiral-Induced Spin Selectivity as a Driving Force in Enantiorecognition: A Generator-and-Reader Perspective手性诱导的自旋选择性作为对映体识别的驱动力：生成器与读取器视角
deleteJournal of Physical Chemistry A
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deleteAndrea Stefani; Claudio Fontanesi
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Correction to “Mechanistic Insights into the Cascade Reactivity of 1,6-Enynes with Arylsulfonyl Chlorides”勘误“1,6-共轭烯炔与芳基磺酰氯串联反应机理的见解”
deleteJournal of Physical Chemistry A
IF2.8
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deleteSelçuk Eşsiz
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New Insights into the Combustion Reaction Kinetics of Ethylene/Nitrous Oxide Green Propellant at Intermediate Temperatures乙烯/一氧化二氮绿色推进剂在中温下的燃烧反应动力学新见解
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deleteHongqiang Zhang; Dan Liu; Yumeng Zhu; Mingwei Gong; Lidong Zhang; Xiaoyuan Zhang
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Collision-Induced Formation and Dissociation of Benzene–Hexafluorobenzene–Benzene Trimers: A Chemical Dynamics Study碰撞诱导的苯–六氟苯–苯三聚体形成与解离：一项化学动力学研究
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IF2.8
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deleteBasudha Deb; Himashree Mahanta; Souvik Shaw; Amit Kumar Paul
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Quantified Interfacial Affinity of Hydrogen Sulfate and Sulfate Speciation in Model Marine Aerosol Particles硫酸氢根和硫酸根在模型海洋气溶胶颗粒中的定量界面亲和力及物种分布
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deleteLeslie M. Ritchie; Madison B. Lester; Arun K. Sharma; Joshua D. Patterson
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Retraction of “Broadband Microwave Spectroscopy of 2-Furanyloxy Radical: Primary Pyrolysis Product of the Second-Generation Biofuel 2-Methoxyfuran”“宽带微波光谱学研究2-呋喃氧基自由基：第二代生物燃料2-甲氧基呋喃的主要热解产物”
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deleteChamara Abeysekera; A.O. Hernandez-Castillo; John F. Stanton; Timothy S. Zwier
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E2(η6–Be6H6) (E = Si–Pb): Doubly Aromatic Inverse-Sandwich ComplexesE2(η6–Be6H6) (E = Si–Pb)：双重芳香性逆三明治配合物
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deleteViviana Roman-Ventura; Dumer S. Sacanamboy; Williams García-Argote; Diego Inostroza; Luis Alvarez-Thon; Luis Leyva-Parra; William Tiznado
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The Open-Shell Organic Systems Database: Diverse CCSD(T)/CBS Reaction Energies for Assessing Density Functional Theory and Machine Learning Methods开放壳有机系统数据库：用于评估密度泛函理论和机器学习方法的各种CCSD(T)/CBS反应能
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deleteAmir Karton
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Intermolecular Hydrogen Bonding Modulates Triplet–Triplet Annihilation Upconversion in a Cationic Sensitizer as Revealed by Transient Electronic Spectroscopy分子间氢键调控阳离子敏化剂中的三重态-三重态湮灭上转换现象，如瞬时电子光谱所示
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deleteDong-Xue Guo; Ying-Ze Li; Zi-Yu Wang; Xin-Yu Liu; Ting-Ting Xie; Qiu-Ting He; Lin-Han Jiang; Yun-Xi Liu; Jia-Yao Li; Wen-Jin An; Dai-Wen Pang; Ling Huang
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Existence of Distinct Equilibrium Configurations under Orienting External Electric Fields在外部取向电场下存在不同的平衡构型
deleteJournal of Physical Chemistry A
IF2.8
delete2026-09-17
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deleteDuc Anh Lai; Devin A. Matthews
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Reactivity of Nb3N3–xOx+ (x = 0–3) toward Methane: Ligand-Controlled Modulation of Nb–Nb σ BondsNb₃N₃₋ₓOₓ⁺ (x = 0–3) 对甲烷的反应性：配体调控的 Nb–Nb σ 键调制
deleteJournal of Physical Chemistry A
IF2.8
delete2026-09-10
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deleteXiao-Xiao Liu; Xi-Guan Zhao; Yu-Zhe Hu; Zi-Yu Li; Sheng-Gui He
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