2015
DOI: 10.1007/s13361-015-1236-5
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Computer Modeling of an Ion Trap Mass Analyzer, Part I: Low Pressure Regime

Abstract: Abstract. We present the multi-particle simulation program suite Computational Ion Trap Analyzer (CITA) designed to calculate the ion trajectories within a Paul quadrupole ion trap developed by the Jet Propulsion Laboratory (JPL). CITA uses an analytical expression of the electrodynamic field, employing up to six terms in multipole expansion and a modified velocity-Verlet method to numerically calculate ion trajectories. The computer code is multithreaded and designed to run on sharedmemory architectures. CITA… Show more

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Cited by 6 publications
(13 citation statements)
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“…These set the upper limit on the pressure within vacuum chamber not to exceed 2.7 × 10 −4 Pa, which for xenon gives a 50% chance of ion-neutral collision every 14 ms. On the other hand, the ion-ion interaction is negligible if the number of ions being confined within the trap does not exceed 5000 during analysis phase. QIT-MS-S has well defined response as a function of both the pressure and the space charge [15] and is further supported by simulations which we use to predict the instrument response under various measurement conditions [16].…”
Section: Qit-ms-smentioning
confidence: 56%
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“…These set the upper limit on the pressure within vacuum chamber not to exceed 2.7 × 10 −4 Pa, which for xenon gives a 50% chance of ion-neutral collision every 14 ms. On the other hand, the ion-ion interaction is negligible if the number of ions being confined within the trap does not exceed 5000 during analysis phase. QIT-MS-S has well defined response as a function of both the pressure and the space charge [15] and is further supported by simulations which we use to predict the instrument response under various measurement conditions [16].…”
Section: Qit-ms-smentioning
confidence: 56%
“…QITMS-S is designed to operate under low-pressure conditions, where ion-neutral collisions as well as ion-ion interaction can be neglected [15]. Previous simulations [16] and measurements show that few collisions of ions with rest gas during analysis phase have negligible effect to peak shapes. These set the upper limit on the pressure within vacuum chamber not to exceed 2.7 × 10 −4 Pa, which for xenon gives a 50% chance of ion-neutral collision every 14 ms. On the other hand, the ion-ion interaction is negligible if the number of ions being confined within the trap does not exceed 5000 during analysis phase.…”
Section: Qit-ms-smentioning
confidence: 99%
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