Ha Hyunwoo, Yoo Mi, An Hyesung, Shin Kihyun, Han Taeyang, Sohn Youhan, Kim Sangyeol, Lee Sang-Ro, Han Jun Hyun, Kim Hyun You
Department of Materials Science and Engineering, Chungnam National University 99 Daehak-ro, Yuseong-gu, Daejeon, 34134, Republic of Korea.
Department of Materials Science and Engineering, KAIST, 291 Daehak-ro, Yuseong-gu, Daejeon, 34141, Korea.
Sci Rep. 2017 Oct 31;7(1):14427. doi: 10.1038/s41598-017-14826-7.
We design a novel method for the CH reduction of SnO for the efficient recovery of Sn from SnO through a study combining theory and experiment. The atomic-level process of CH-SnO interaction and temperature-dependent reduction behavior of SnO were studied with a combination of a multi-scale computational method of thermodynamic simulations and density functional theory (DFT) calculations. We found that CH was a highly efficient and a versatile reducing agent, as the total reducing power of CH originates from the carbon and hydrogen of CH, which sequentially reduce SnO. Moreover, as a result of the CH reduction of SnO, a mixture of CO and H was produced as a gas-phase product (syngas). The relative molar ratio of the produced gas-phase product was controllable by the reduction temperature and the amount of supplied CH. The laboratory-scale experimental study confirmed that CH actively reduces SnO, producing 99.34% high-purity Sn and H and CO. Our results present a novel method for an efficient, green, and economical recycling strategy for Sn with economic value added that is held by the co-produced clean energy source (syngas).
我们通过理论与实验相结合的研究,设计了一种用于SnO碳热还原的新方法,以实现从SnO中高效回收Sn。结合热力学模拟和密度泛函理论(DFT)计算的多尺度计算方法,研究了CH与SnO相互作用的原子级过程以及SnO的温度依赖性还原行为。我们发现CH是一种高效且通用的还原剂,因为CH的总还原能力源自CH中的碳和氢,它们依次还原SnO。此外,由于SnO的碳热还原,会产生CO和H的混合物作为气相产物(合成气)。所产生的气相产物的相对摩尔比可通过还原温度和供应的CH量来控制。实验室规模的实验研究证实,CH能有效还原SnO,产生纯度为99.34%的高纯度Sn以及H和CO。我们的研究结果提出了一种高效、绿色且经济的Sn回收策略新方法,该方法还附带由联产清洁能源(合成气)带来的经济附加值。