Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies
A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the ma...
Ausführliche Beschreibung
Autor*in: |
Yu, Hewei [verfasserIn] Sun, Jichao [verfasserIn] Chen, Xiuxiu [verfasserIn] Wang, Bing [verfasserIn] Liang, Xiaohui [verfasserIn] Gao, Mingjie [verfasserIn] Si, Hongyu [verfasserIn] |
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Format: |
E-Artikel |
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Sprache: |
Englisch |
Erschienen: |
2023 |
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Schlagwörter: |
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Übergeordnetes Werk: |
Enthalten in: Renewable energy - Amsterdam [u.a.] : Elsevier Science, 1991, 217 |
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Übergeordnetes Werk: |
volume:217 |
DOI / URN: |
10.1016/j.renene.2023.119138 |
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Katalog-ID: |
ELV065178831 |
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520 | |a A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. | ||
650 | 4 | |a Biodiesel | |
650 | 4 | |a Catalyst | |
650 | 4 | |a Acid-base dual function | |
650 | 4 | |a Molecular simulations | |
700 | 1 | |a Sun, Jichao |e verfasserin |4 aut | |
700 | 1 | |a Chen, Xiuxiu |e verfasserin |4 aut | |
700 | 1 | |a Wang, Bing |e verfasserin |4 aut | |
700 | 1 | |a Liang, Xiaohui |e verfasserin |4 aut | |
700 | 1 | |a Gao, Mingjie |e verfasserin |4 aut | |
700 | 1 | |a Si, Hongyu |e verfasserin |4 aut | |
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10.1016/j.renene.2023.119138 doi (DE-627)ELV065178831 (ELSEVIER)S0960-1481(23)01052-2 DE-627 ger DE-627 rda eng 530 620 VZ 52.56 bkl Yu, Hewei verfasserin aut Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. Biodiesel Catalyst Acid-base dual function Molecular simulations Sun, Jichao verfasserin aut Chen, Xiuxiu verfasserin aut Wang, Bing verfasserin aut Liang, Xiaohui verfasserin aut Gao, Mingjie verfasserin aut Si, Hongyu verfasserin aut Enthalten in Renewable energy Amsterdam [u.a.] : Elsevier Science, 1991 217 Online-Ressource (DE-627)320412091 (DE-600)2001449-1 (DE-576)252613937 1879-0682 nnns volume:217 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.56 Regenerative Energieformen alternative Energieformen VZ AR 217 |
spelling |
10.1016/j.renene.2023.119138 doi (DE-627)ELV065178831 (ELSEVIER)S0960-1481(23)01052-2 DE-627 ger DE-627 rda eng 530 620 VZ 52.56 bkl Yu, Hewei verfasserin aut Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. Biodiesel Catalyst Acid-base dual function Molecular simulations Sun, Jichao verfasserin aut Chen, Xiuxiu verfasserin aut Wang, Bing verfasserin aut Liang, Xiaohui verfasserin aut Gao, Mingjie verfasserin aut Si, Hongyu verfasserin aut Enthalten in Renewable energy Amsterdam [u.a.] : Elsevier Science, 1991 217 Online-Ressource (DE-627)320412091 (DE-600)2001449-1 (DE-576)252613937 1879-0682 nnns volume:217 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.56 Regenerative Energieformen alternative Energieformen VZ AR 217 |
allfields_unstemmed |
10.1016/j.renene.2023.119138 doi (DE-627)ELV065178831 (ELSEVIER)S0960-1481(23)01052-2 DE-627 ger DE-627 rda eng 530 620 VZ 52.56 bkl Yu, Hewei verfasserin aut Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. Biodiesel Catalyst Acid-base dual function Molecular simulations Sun, Jichao verfasserin aut Chen, Xiuxiu verfasserin aut Wang, Bing verfasserin aut Liang, Xiaohui verfasserin aut Gao, Mingjie verfasserin aut Si, Hongyu verfasserin aut Enthalten in Renewable energy Amsterdam [u.a.] : Elsevier Science, 1991 217 Online-Ressource (DE-627)320412091 (DE-600)2001449-1 (DE-576)252613937 1879-0682 nnns volume:217 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.56 Regenerative Energieformen alternative Energieformen VZ AR 217 |
allfieldsGer |
10.1016/j.renene.2023.119138 doi (DE-627)ELV065178831 (ELSEVIER)S0960-1481(23)01052-2 DE-627 ger DE-627 rda eng 530 620 VZ 52.56 bkl Yu, Hewei verfasserin aut Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. Biodiesel Catalyst Acid-base dual function Molecular simulations Sun, Jichao verfasserin aut Chen, Xiuxiu verfasserin aut Wang, Bing verfasserin aut Liang, Xiaohui verfasserin aut Gao, Mingjie verfasserin aut Si, Hongyu verfasserin aut Enthalten in Renewable energy Amsterdam [u.a.] : Elsevier Science, 1991 217 Online-Ressource (DE-627)320412091 (DE-600)2001449-1 (DE-576)252613937 1879-0682 nnns volume:217 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.56 Regenerative Energieformen alternative Energieformen VZ AR 217 |
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10.1016/j.renene.2023.119138 doi (DE-627)ELV065178831 (ELSEVIER)S0960-1481(23)01052-2 DE-627 ger DE-627 rda eng 530 620 VZ 52.56 bkl Yu, Hewei verfasserin aut Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. Biodiesel Catalyst Acid-base dual function Molecular simulations Sun, Jichao verfasserin aut Chen, Xiuxiu verfasserin aut Wang, Bing verfasserin aut Liang, Xiaohui verfasserin aut Gao, Mingjie verfasserin aut Si, Hongyu verfasserin aut Enthalten in Renewable energy Amsterdam [u.a.] : Elsevier Science, 1991 217 Online-Ressource (DE-627)320412091 (DE-600)2001449-1 (DE-576)252613937 1879-0682 nnns volume:217 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_101 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.56 Regenerative Energieformen alternative Energieformen VZ AR 217 |
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530 620 VZ 52.56 bkl Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies Biodiesel Catalyst Acid-base dual function Molecular simulations |
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Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies |
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Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies |
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Yu, Hewei Sun, Jichao Chen, Xiuxiu Wang, Bing Liang, Xiaohui Gao, Mingjie Si, Hongyu |
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synthesis of a novel acid-base bifunctional zn/ca–zr catalyst for biodiesel application: experimental and molecular simulation studies |
title_auth |
Synthesis of a novel acid-base bifunctional Zn/Ca–Zr catalyst for biodiesel application: Experimental and molecular simulation studies |
abstract |
A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. |
abstractGer |
A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. |
abstract_unstemmed |
A novel acid-base bifunctional Zn/Ca–Zr catalyst has been synthesized successfully for biodiesel production from palm oil and acidified oil. The influence of synthetic factors on the catalytic activity of resulting Zn/Ca–Zr were discussed. Furthermore, the FAMEs yield was optimized to achieve the maximum value using the Taguchi approach. Results showed that the catalyst synthesized using a metal stoichiometric ratio of 4 : 4: 4, hydrothermal conditions, and activation temperature of 850 °C exhibited the best activity. The highest FAMEs yield was found to be 94.9% under the conditions of 5 wt% catalyst dosage, methanol/palm oil molar ratio of 20, and temperature of 170 °C at 3 h. The contribution percentage indicated that the methanol/oil molar ratio had the most significant effect on the FAMEs yield. Moreover, the Zn/Ca–Zr catalyst can catalyze the simultaneous esterification and transesterification of acidified palm oil with a 95.1% FAMEs yield and 93.3% acid reduction rate. And a 78.2% FAMEs yield can be maintained after four repeated cycles. Molecular simulations indicated the active site of Zn was more easily attacked by FFAs for esterification, while the active site of Ca was retained to adsorb methanol for transesterification, which explained the catalyst's acid-base bifunctional characteristics. |
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