Role of Hydrogen in High-Yield Growth of Boron Nitride Nanotubes at Atmospheric Pressure by Induction Thermal Plasma

被引:74
作者
Kim, Keun Su [1 ,3 ]
Couillard, Martin [2 ]
Shin, Homin [1 ]
Plunkett, Mark [1 ]
Ruth, Dean [1 ]
Kingston, Christopher T. [1 ]
Simard, Benoit [1 ]
机构
[1] Natl Res Council Canada, Emerging Technol Div, Secur & Disrupt Technol Res Ctr, Ottawa, ON K1A 0R6, Canada
[2] Natl Res Council Canada, Div Engn, Energy Min & Environm Res Ctr, Ottawa, ON K1A 0R6, Canada
[3] Univ Toronto, Dept Mech & Ind Engn, 5 Kings Coll Rd, Toronto, ON M5S 3G8, Canada
关键词
boron nitride nanotubes; scalable manufacturing; hydrogen-catalyzed; induction thermal plasma; thermofluid simulation; optical emission spectroscopy; density functional theory; WALLED CARBON NANOTUBES; MINIMUM ENERGY PATHS; ELASTIC BAND METHOD; COUPLED PLASMA; SADDLE-POINTS; LASER; NANOCOMPOSITES; ASSEMBLIES; LIFETIME; NITROGEN;
D O I
10.1021/acsnano.7b08708
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
We recently demonstrated scalable manufacturing of boron nitride nanotubes (BNNTs) directly from hexagonal BN (hBN) powder by using induction thermal plasma, with a high-yield rate approaching 20 g/h. The main finding was that the presence of hydrogen is crucial for the high yield growth of BNNTs. Here we investigate the detailed role of hydrogen by numerical modeling and in situ optical emission spectroscopy (OES) and reveal that both the thermofluidic fields and chemical pathways are significantly altered by hydrogen in favor of rapid growth of BNNTs. The numerical simulation indicated improved particle heating and quenching rates (similar to 10(5) K/s) due to the high thermal conductivity of hydrogen over the temperature range of 3500-4000 K. These are crucial for the complete vaporization of the hBN feedstock and rapid formation of nanosized B droplets for the subsequent BNNT growth. Hydrogen is also found to extend the active BNNT growth zone toward the reactor downstream, maintaining the gas temperature above the B solidification limit (similar to 2300 K) by releasing the recombination heat of H atoms, which starts at 3800 K. The OES study revealed that H radicals also stabilize B or N radicals from dissociation of the feedstock as BH and NH radicals while suppressing the formation of N-2 or N-2(+) species. Our density functional theory calculations showed that such radicals can provide faster chemical pathways for the formation of BN compared with relatively inert N-2.
引用
收藏
页码:884 / 893
页数:10
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