Three Dimensional Many Particle Simulation for Peak Coalescence and Ion Loss Resulting from Coulomb Interactions between Ions in an FT-ICR Mass Spectrometer

Makoto Fujiwara

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Three Dimensional Many Particle Simulation for Peak Coalescence and Ion Loss Resulting from Coulomb Interactions between Ions in an FT-ICR Mass Spectrometer

机译：FT-ICR质谱仪中用于峰凝聚和离子之间库仑相互作用导致的离子损失的三维多粒子模拟

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A three dimensional many particle model is proposed for computer simulation of Fourier transform ion cyclotron resonance (FT-ICR) mass spectra. The model is relatively simple and includes Coulomb interactions between ions in an FT-ICR cell. FT-ICR mass spectra of CO~+ and C_2H~+_4 mixtures are simulated at CO~+: C_2H~+_4= 1:1,2:1, and 1:2 for low, medium, and high ion density. The Coulomb interaction at CO~+:C_2H~+_4=1:1 appears to be the most significant from the results on peak coalescence phenomenon.

机译：提出了三维多粒子模型，用于计算机模拟傅立叶变换离子回旋共振（FT-ICR）质谱。该模型相对简单，包括FT-ICR单元中离子之间的库仑相互作用。对于CO〜+和C_2H〜+ _4混合物的FT-ICR质谱在CO〜+处进行模拟：C_2H〜+ _4 = 1：1,2：1，而对于低，中和高离子密度，则为1：2。从峰聚结现象的结果来看，CO〜+：C_2H〜+ _4 = 1：1时的库仑相互作用似乎最为明显。

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《Journal of the Mass Spectrometry Society of Japan》 |2000年第4期|p.263-269|共7页
作者
Makoto Fujiwara;
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正文语种 jpn
中图分类分析化学;一般工业技术;
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1. Three Dimensional Many Particle Simulation for Peak Coalescence and Ion Loss Resulting from Coulomb Interactions between Ions in an FT-ICR Mass Spectrometer [J] . Makoto Fujiwara Journal of the Mass Spectrometry Society of Japan . 2000,第4期

机译：FT-ICR质谱仪中用于峰聚结和离子之间库仑相互作用导致的离子损失的三维多粒子模拟
2. Influence of Ion-Ion Coulomb Interactions on FT-ICR Mass Spectra at a High Magnetic Field: A Many-Particle Simulation Using a Special-Purpose Computer [J] . Makoto Fujiwara, rnNaohisa Happo, rnKoichi Tanaka Journal of the Mass Spectrometry Society of Japan . 2010,第5期

机译：高磁场下离子库仑相互作用对FT-ICR质谱的影响：使用专用计算机的多粒子模拟
3. Influence of Ion-Ion Coulomb Interactions on FT-ICR Mass Spectra at a High Magnetic Field: A Many-Particle Simulation Using a Special-Purpose Computer [J] . Makoto FUJIWARA, Naohisa HAPPO, Koichi TANAKA Journal of the Mass Spectrometry Society of Japan . 2010,第5期

机译：高磁场下离子库仑相互作用对FT-ICR质谱的影响：使用专用计算机的多粒子模拟
4. Coulomb-Interaction-Induced Effects on FT-ICR Mass Spectral Peak Shape: A Many-Particle Simulation Using GRAPE [C] . Makoto Fujiwara, Naohisa Happo, Koichi Tanaka International Mass Spectrometry Conference . 2014

机译：库仑 - 相互作用诱导对FT-ICR质谱峰值的影响：使用葡萄的多种粒子模拟
5. Structural elucidation of organic molecules and analysis of petroleum fractions via ion -molecule reactions in a Fourier transform ion cyclotron resonance (FT-ICR) mass spectrometer [D] . Duan, Penggao 2008

机译：在傅立叶变换离子回旋共振（FT-ICR）质谱仪中通过离子分子反应对有机分子进行结构解析并分析石油馏分
6. Protein solvation from theory and simulation: Exact treatment of Coulomb interactions in three-dimensional theories [O] . John S. Perkyns, Gillian C. Lynch, Jesse J. Howard, -1

机译：来自理论和模拟的蛋白质溶剂化：三维理论中对库仑相互作用的精确处理
7. Three Dimensional Many Particle Simulation for Peak Coalescence and Ion Loss Resulting from Coulomb Interactions between Ions in an FT-ICR Mass Spectrometer. [O] . Makoto FUJIWARA 2000

机译：三维许多粒子仿真，用于峰聚结和离子损失，由FT-ICR质谱仪中离子之间的Coulomb相互作用产生。
8. Bnl Multiparticle Spectrometer (Mps) and an Observation of a Peak in the Anti K exp 0 pi exp + pi exp - Effective Mass at 1700 Mev [R] . Foley, K. J., Etkin, A., Goldman, J. H. 1976

机译：Bnl多粒子光谱仪（mps）和anti K exp 0 pi exp + pi exp中的峰值观察 - 1700 mev时的有效质量

Three Dimensional Many Particle Simulation for Peak Coalescence and Ion Loss Resulting from Coulomb Interactions between Ions in an FT-ICR Mass Spectrometer

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