CFD optimization of photochemical
UV reactors for VOC degradation
Anna Andersson
Sustainable Process Engineering, master's level
2017
Luleå University of Technology
V̇
𝑂3+ ℎ𝑣 (243 − 310 𝑛𝑚) → 𝑂(1𝐷)+ 𝑂2
𝑂2+ ℎ𝑣 (< 243 𝑛𝑚) → 𝑂(1𝐷)+ 𝑂(3𝑃)
𝑂𝐻+ 𝑃 → 𝑃+ 𝐻2𝑂 𝑃+ 𝑂2→ 𝐶𝑂2+ 𝐻2𝑂 𝑂𝐻+ 𝑝𝑜𝑙𝑙𝑢𝑡𝑎𝑛𝑡 + 𝑂2 → 𝑝𝑟𝑜𝑑𝑢𝑐𝑡𝑠 (𝐶𝑂2, 𝐻2𝑂 𝑒𝑡𝑐. ) 𝑂(1𝐷)+ 𝐻 2𝑂 → 2𝑂𝐻
𝑇𝑖𝑂2+ ℎ𝑣 → ℎ++ 𝑒− ℎ++ 𝑂𝐻−→ 𝑂𝐻 ℎ++ 𝐻 2𝑂 → 𝑂𝐻+ 𝐻+ 𝑂3+ 𝑒−→ 𝑂3 − 𝐻++ 𝑂3 −→ 𝐻𝑂3 𝐻𝑂3 → 𝑂2+ 𝑂𝐻
𝑂2+ ℎ𝑣 (< 243 𝑛𝑚) → 𝑂(1𝐷)+ 𝑂(3𝑃)
𝑂(1𝐷)+ M → 𝑂(3𝑃)+ 𝑀
𝑂(3𝑃)+ 𝑀 + 𝑂
V̇
𝑝2= (𝐻 − ℎ)2+ 𝑥2 1 (𝑝2) 𝑑(𝑝2𝐼) 𝑑𝑝 = −𝜎𝐼
𝐼 = 𝐼𝑠 𝑑ℎ 4 𝜋 𝑝2𝑒−𝜎𝑝 𝐼𝐸= 𝐼𝑠 𝑑ℎ 4 𝜋 𝑝2 𝐼𝐸= ∫ 𝑃𝑙𝑎𝑚𝑝 𝐸𝑓𝑓𝑖𝑟𝑟𝑎𝑑𝑖𝑎𝑡𝑖𝑜𝑛 𝑑ℎ 4 𝜋 (𝑥2+(𝐻−ℎ)2) 𝐿/2 −𝐿/2 = 𝑃𝑙𝑎𝑚𝑝 𝐸𝑓𝑓𝑖𝑟𝑟𝑎𝑑𝑖𝑎𝑡𝑖𝑜𝑛 4 𝜋 ∫ 1 (𝑥2+(𝐻−ℎ)2) 𝑑ℎ 𝐿/2 −𝐿/2 𝐼𝐸= 𝑃𝑙𝑎𝑚𝑝 𝐸𝑓𝑓𝑖𝑟𝑟𝑎𝑑𝑖𝑎𝑡𝑖𝑜𝑛 4 𝜋 𝐿 𝑥 [arctan ( 𝐿/2+𝐻 𝑥 ) + arctan ( 𝐿/2−𝐻 𝑥 )] 𝐼𝑇 185 𝑛𝑚= 𝐼𝐸 𝑒−𝜎𝑂2 𝐶𝑂2 𝑥 σO2 CO2=
Absair (absorption air)
𝐼𝑇 254 𝑛𝑚= 𝐼𝐸 𝑒−𝜎𝑂3 𝐶𝑂3 𝑥 𝐼𝑇 = ∫ ( 𝑃𝑙𝑎𝑚𝑝 4 𝜋 𝐿 [( 1 𝐻+𝐿2) 2 + 𝑥2− (𝐿1 2−𝐻 ) 2 + 𝑥2] 𝑒 −𝐴𝑏𝑠𝐴𝑖𝑟 √( 1 𝐻+𝐿2) 2 +𝑥2−( 1 𝐿 2−𝐻 ) 2 +𝑥2 ) 𝐻 𝑚𝑎𝑥 𝐻 𝑚𝑖𝑛 𝐼𝑇 185 𝑛𝑚= 𝐼𝐸 𝑒−𝐴𝑏𝑠𝑎𝑖𝑟 𝑥 𝑘𝑠𝑖𝑧𝑒 𝐼𝑇 254 𝑛𝑚= 𝐼𝐸 𝑒−𝜎 𝐶𝑂3 𝑥 𝑘𝑠𝑖𝑧𝑒
𝑂3 𝑔𝑒𝑛𝑒𝑟𝑎𝑡𝑖𝑜𝑛= 2 𝐴𝑏𝑠𝑝ℎ𝑜𝑡𝑜𝑛 𝑁𝐴 𝐴𝑏𝑠𝑝ℎ𝑜𝑡𝑜𝑛= 𝐴𝑏𝑠185 𝐸𝑛185 𝐴𝑏𝑠185= 𝐼𝐸− 𝐼𝑇 185 𝑛𝑚 𝑅𝑂3 𝑑𝑒𝑐 [𝑂𝐻] 𝑅𝑉𝑂𝐶 𝑑𝑒𝑐 𝑅𝑉𝑂𝐶 𝑑𝑒𝑐 = 𝑘𝑝𝑎𝑟 [𝑉𝑂𝐶] [𝑂𝐻] = 𝑘𝑝𝑎𝑟 [𝑉𝑂𝐶] 𝑅𝑂3 𝑑𝑒𝑐
𝑅𝑂3 𝑑𝑒𝑐 𝐼𝐸− 𝐼𝑇 254 𝑛𝑚 𝑅𝑂3 𝑑𝑒𝑐 𝐼𝐸− 𝐼𝐸 𝑒−𝜎 𝐶𝑂3 𝑥 𝑘𝑠𝑖𝑧𝑒 = 𝐼𝐸 (1 − 𝑒−𝜎 𝐶𝑂3 𝑥 𝑘𝑠𝑖𝑧𝑒) 𝑅𝑉𝑂𝐶 𝑑𝑒𝑐 = 𝑘𝑝𝑎𝑟 [𝑉𝑂𝐶] (𝐼𝐸 (1 − 𝑒−𝜎 𝐶𝑂3 𝑥))
𝜌(𝑈 ∙ ∇𝑈) + ∇ ∙ (𝜇𝑇(∇𝑈 + (∇𝑈)𝑇) −23𝜇𝑇(∇ ∙ 𝑈)𝐼) = −∇𝑃 + ∇ ∙ (𝜇(∇𝑈 + (∇𝑈)𝑇) −23𝜇(∇ ∙ 𝑈)𝐼) + 𝐹 ∇ ∙ 𝑈 = 0 𝜕𝐶𝑖 𝜕𝑡 + ∇ ∙ 𝑁𝑖 = 𝑅𝑖
∂Ci ∂t
0% 20% 40% 60% 80% 100% 5 cm 6 cm 8 cm 9 cm 10 cm 12 cm 14 cm 16 cm 18 cm 20 cm Con ve rs ion Lamp distance
Conversion for lamp distance trials
COMSOL results Normalized results
0% 20% 40% 60% 80% 100% 3 4e 5 6 7 8 9 N o rm aliz ed con ve rs ion Case number
0% 20% 40% 60% 80% 100% 120% 140% 1 10a 10b 4e 11a 11b 11c N o rm aliz ed con ve rs ion Case number
0% 20% 40% 60% 80% 100% 120% A1 A2 B1 B2 C N o rm aliz ed con ve rs ion Case number
0% 20% 40% 60% 80% 100% 120% A1 D B1 E C F1 F2 N o rm aliz ed con ve rs ion Case number
0% 20% 40% 60% 80% 100% A1 G H I J N o rm aliz ed con ve rs ion Case number
0% 20% 40% 60% 80% 100% 120% 140% 160% C K L M N o rm aliz ed con ve rs ion Case number
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