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h5 指数:54
h5 中位数:64

h5 指数是指在过去整整 5 年中所发表文章的 h 指数。h 指在 2018-2022 年间发表的 h 篇文章每篇至少都被引用过 h 次的最大值。隐藏

出版物的 h5 中位数，是指出版物的 h5 指数所涵盖的所有文章获得的引用次数的中位值。隐藏

#5 Spectroscopy & Molecular Physics

标题/作者	引用次数	年份
Performance and Cost Assessment of Machine Learning Interatomic Potentials Y Zuo, C Chen, X Li, Z Deng, Y Chen, J Behler, G Csányi, AV Shapeev, ... The Journal of Physical Chemistry A 124 (4), 731-745	429	2020
Minimally Empirical Double-Hybrid Functionals Trained against the GMTKN55 Database: revDSD-PBEP86-D4, revDOD-PBE-D4, and DOD-SCAN-D4 G Santra, N Sylvetsky, JML Martin The Journal of Physical Chemistry A 123 (24), 5129-5143	212	2019
Exploration of Reaction Pathways and Chemical Transformation Networks GN Simm, AC Vaucher, M Reiher The Journal of Physical Chemistry A 123 (2), 385-399	156	2018
Comprehensive Benchmark Results for the Domain Based Local Pair Natural Orbital Coupled Cluster Method (DLPNO-CCSD (T)) for Closed-and Open-Shell Systems DG Liakos, Y Guo, F Neese The Journal of Physical Chemistry A 124 (1), 90-100	155	2019
Theoretical Insights Into the Excited State Double Proton Transfer Mechanism of Deep Red Pigment Alkannin J Zhao, H Dong, Y Zheng The Journal of Physical Chemistry A 122 (5), 1200-1208	153	2018
Singlet Oxygen Reactivity with Carbonate Solvents Used for Li-Ion Battery Electrolytes ATS Freiberg, MK Roos, J Wandt, R de Vivie-Riedle, HA Gasteiger The Journal of Physical Chemistry A 122 (45), 8828-8839	117	2018
Methylammonium Cation Dynamics in Methylammonium Lead Halide Perovskites: A Solid-State NMR Perspective GM Bernard, RE Wasylishen, CI Ratcliffe, V Terskikh, Q Wu, JM Buriak, ... The Journal of Physical Chemistry A 122 (6), 1560-1573	114	2018
Calculation of Reaction Free Energies in Solution: A Comparison of Current Approaches M Besora, P Vidossich, A Lledós, G Ujaque, F Maseras The Journal of Physical Chemistry A 122 (5), 1392-1399	102	2018
New Way for Probing Bond Strength J Klein, H Khartabil, JC Boisson, J Contreras-García, JP Piquemal, ... The Journal of Physical Chemistry A 124 (9), 1850-1860	100	2020
Stiff-PINN: Physics-Informed Neural Network for Stiff Chemical Kinetics W Ji, W Qiu, Z Shi, S Pan, S Deng The Journal of Physical Chemistry A 125 (36), 8098-8106	97	2021
Information-Theoretic Approaches to Atoms-in-Molecules: Hirshfeld Family of Partitioning Schemes. F Heidar-Zadeh, PW Ayers, T Verstraelen, I Vinogradov, ... The Journal of Physical chemistry. A 122 (17), 4219-4245	96	2018
Accelerated ReaxFF Simulations for Describing the Reactive Cross-Linking of Polymers A Vashisth, C Ashraf, W Zhang, CE Bakis, ACT van Duin The Journal of Physical Chemistry A 122 (32), 6633-6642	95	2018
Excited States of Methylene, Polyenes, and Ozone from Heat-Bath Configuration Interaction AD Chien, AA Holmes, M Otten, CJ Umrigar, S Sharma, PM Zimmerman The Journal of Physical Chemistry A 122 (10), 2714-2722	88	2018
Bayesian Optimization for Calibrating and Selecting Hybrid-Density Functional Models RA Vargas− Hernández The Journal of Physical Chemistry A 124 (20), 4053-4061	85	2020
Evaluating Transition Metal Barrier Heights with the Latest Density Functional Theory Exchange–Correlation Functionals: The MOBH35 Benchmark Database MA Iron, T Janes The Journal of Physical Chemistry A 123 (17), 3761-3781	84	2019
Understanding the Mechanism Stabilizing Intermediate Spin States in Fe (II)-Porphyrin G Li Manni, A Alavi The Journal of Physical Chemistry A 122 (22), 4935-4947	83	2018
Efficient Quantum Chemical Calculation of Structure Ensembles and Free Energies for Nonrigid Molecules S Grimme, F Bohle, A Hansen, P Pracht, S Spicher, M Stahn The Journal of Physical Chemistry A 125 (19), 4039-4054	82	2021
Unimolecular Reactions of Peroxy Radicals Formed in the Oxidation of α-Pinene and β-Pinene by Hydroxyl Radicals L Xu, KH Møller, JD Crounse, RV Otkjær, HG Kjaergaard, PO Wennberg The Journal of Physical Chemistry A 123 (8), 1661-1674	77	2019
Iron (II) and Iron (III) Spin Crossover: Toward an Optimal Density Functional OS Siig, KP Kepp The Journal of Physical Chemistry A 122 (16), 4208-4217	76	2018
Training Neural Nets To Learn Reactive Potential Energy Surfaces Using Interactive Quantum Chemistry in Virtual Reality S Amabilino, LA Bratholm, SJ Bennie, AC Vaucher, M Reiher, ... The Journal of Physical Chemistry A 123 (20), 4486-4499	75	2019

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