日期 影响因子
日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:
–

Machine-Learning Ice Spectra: From 1 to 256 Features

机器学习冰光谱：从 1 到 256 个特征

期刊:Journal of Chemical Theory and Computation
影响因子:5.5
doi:10.1021/acs.jctc.5c01413
Shermukhamedov, Shokirbek; Kullgren, Jolla; Sethio, Daniel; Hermansson, Kersti
发表日期：2026
文献求助 收藏

Limitations of Cluster-Trained MLIPs for Liquid Density and Diffusivity

聚类训练的MLIP在液体密度和扩散率方面的局限性

期刊:Journal of Chemical Theory and Computation
影响因子:5.5
doi:10.1021/acs.jctc.5c02043
Svahn, Viktor; Magdău, Ioan-Bogdan; Niblett, Samuel P; Csányi, Gábor; Hermansson, Kersti; Kullgren, Jolla
发表日期：2026
文献求助 收藏

Author Correction: The dynamics of plasmon-induced hot carrier creation in colloidal gold

作者更正：胶体金中等离子体激元诱导热载流子产生的动力学

期刊:Nature Communications
影响因子:15.7
doi:10.1038/s41467-025-58580-1
Wach, Anna; Bericat-Vadell, Robert; Bacellar, Camila; Cirelli, Claudio; Johnson, Philip J M; Castillo, Rebeca G; Silveira, Vitor R; Broqvist, Peter; Kullgren, Jolla; Maximenko, Alexey; Sobol, Tomasz; Partyka-Jankowska, Ewa; Nordlander, Peter; Halas, Naomi J; Szlachetko, Jakub; Sá, Jacinto
发表日期：2025
文献求助 收藏

The dynamics of plasmon-induced hot carrier creation in colloidal gold

胶体金中等离子体激元诱导热载流子产生的动力学

期刊:Nature Communications
影响因子:15.7
doi:10.1038/s41467-025-57657-1
Wach, Anna; Bericat-Vadell, Robert; Bacellar, Camila; Cirelli, Claudio; Johnson, Philip J M; Castillo, Rebeca G; Silveira, Vitor R; Broqvist, Peter; Kullgren, Jolla; Maximenko, Alexey; Sobol, Tomasz; Partyka-Jankowska, Ewa; Nordlander, Peter; Halas, Naomi J; Szlachetko, Jakub; Sá, Jacinto
发表日期：2025
文献求助 收藏

Predicting Frequency from the External Chemical Environment: OH Vibrations on Hydrated and Hydroxylated Surfaces

从外部化学环境预测频率：水合和羟基化表面上的OH振动

期刊:Journal of Chemical Theory and Computation
影响因子:5.5
doi:10.1021/acs.jctc.2c00135
Röckert, Andreas; Kullgren, Jolla; Hermansson, Kersti
发表日期：2022
文献求助 收藏

Phonon-Assisted Hot Carrier Generation in Plasmonic Semiconductor Systems

等离子体半导体系统中声子辅助的热载流子生成

期刊:Nano Letters
影响因子:9.1
doi:10.1021/acs.nanolett.0c04419
Hattori, Yocefu; Meng, Jie; Zheng, Kaibo; Meier de Andrade, Ageo; Kullgren, Jolla; Broqvist, Peter; Nordlander, Peter; Sá, Jacinto
发表日期：2021
文献求助 收藏

Curvature Constrained Splines for DFTB Repulsive Potential Parametrization

DFTB排斥势参数化的曲率约束样条

期刊:Journal of Chemical Theory and Computation
影响因子:5.5
doi:10.1021/acs.jctc.0c01156
Ammothum Kandy, Akshay Krishna; Wadbro, Eddie; Aradi, Bálint; Broqvist, Peter; Kullgren, Jolla
发表日期：2021
文献求助 收藏

Using DFTB to Model Photocatalytic Anatase-Rutile TiO(2) Nanocrystalline Interfaces and Their Band Alignment

利用DFTB方法模拟光催化锐钛矿-金红石型TiO(2)纳米晶界面及其能带排列

期刊:Journal of Chemical Theory and Computation
影响因子:5.5
doi:10.1021/acs.jctc.1c00399
Gupta, Verena Kristin; Aradi, Bálint; Kweon, Kyoung; Keilbart, Nathan; Goldman, Nir; Frauenheim, Thomas; Kullgren, Jolla
发表日期：2021
文献求助 收藏

Photoinduced Adsorption and Oxidation of SO(2) on Anatase TiO(2)(101)

锐钛矿型二氧化钛(101)上SO(2)的光致吸附和氧化

期刊:Journal of the American Chemical Society
影响因子:15.6
doi:10.1021/jacs.0c09683
Langhammer, David; Kullgren, Jolla; Österlund, Lars
发表日期：2020
文献求助 收藏

Density Functional Tight Binding Theory Approach for the CO(2) Reduction Reaction Paths on Anatase TiO(2) Surfaces

采用密度泛函紧束缚理论方法研究锐钛矿型二氧化钛表面上的CO(2)还原反应路径

期刊:ACS Omega
影响因子:4.3
doi:10.1021/acsomega.0c03117
Pazoki, Meysam; Larsson, Ernst Dennis; Kullgren, Jolla
发表日期：2020
文献求助 收藏