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

Reduced Density Matrix and Cumulant Approximations of Quantum Linear Response

量子线性响应的约化密度矩阵和累积量近似

von Buchwald, Theo Juncker; Kjellgren, Erik Rosendahl; Kongsted, Jacob; Sauer, Stephan P A; Coriani, Sonia; Ziems, Karl Michael

Substantial Magnetic Fields Arising from Ballistic Ring Currents in Single-Molecule Junctions

单分子结中弹道环电流产生的强磁场

Bro-Jørgensen, William; Sauer, Stephan P A; Solomon, Gemma C; Garner, Marc H

RPA(D) and HRPA(D): Calculating NMR Spin-Spin Coupling Constants in Free Amino Acid Residues

RPA(D) 和 HRPA(D):计算游离氨基酸残基的 NMR 自旋-自旋耦合常数

Møller, Christoffer H S; Sauer, Stephan P A

Correction: Schaltz et al. A Theoretical Study of Hydrogen Abstraction Reactions in Guanosine and Uridine. Int. J. Mol. Sci. 2023, 24, 8192

更正:Schaltz 等人,《鸟苷和尿苷中氢提取反应的理论研究》,《国际分子科学杂志》,2023 年,第 24 卷,第 8192 页。

Schaltz, Kasper F; Sauer, Stephan P A

A Combined Experimental and Theoretical Study of ESR Hyperfine Coupling Constants for N,N,N',N'-Tetrasubstituted p-Phenylenediamine Radical Cations

对N,N,N',N'-四取代对苯二胺自由基阳离子的ESR超精细耦合常数进行实验与理论相结合的研究

Gleeson, Ronan; Andersen, Cecilie L; Rapta, Peter; Machata, Peter; Christensen, Jørn B; Hammerich, Ole; Sauer, Stephan P A

Magnesium(II)-ATP Complexes in 1-Ethyl-3-Methylimidazolium Acetate Solutions Characterized by (31) Mg β-Radiation-Detected NMR Spectroscopy

利用 (31) Mg β 辐射检测核磁共振波谱法表征 1-乙基-3-甲基咪唑乙酸盐溶液中的镁(II)-ATP 复合物

McFadden, Ryan M L; Szunyogh, Dániel; Bravo-Frank, Nicholas; Chatzichristos, Aris; Dehn, Martin H; Fujimoto, Derek; Jancsó, Attila; Johannsen, Silke; Kálomista, Ildikó; Karner, Victoria L; Kiefl, Robert F; Larsen, Flemming H; Lassen, Jens; Levy, C D Philip; Li, Ruohong; McKenzie, Iain; McPhee, Hannah; Morris, Gerald D; Pearson, Matthew R; Sauer, Stephan P A; Sigel, Roland K O; Thulstrup, Peter W; MacFarlane, W Andrew; Hemmingsen, Lars; Stachura, Monika

Noniterative Doubles Corrections to the Random Phase and Higher Random Phase Approximations: Singlet and Triplet Excitation Energies

随机相位和高阶随机相位近似的非迭代双峰修正:单重态和三重态激发能

Haase, Pi A B; Faber, Rasmus; Provasi, Patricio F; Sauer, Stephan P A