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Volumn 41, Issue 9, 2012, Pages 1610-1630

COSMO-RS based predictions for the extraction of lignin from lignocellulosic biomass using ionic liquids: Effect of cation and anion combination

Author keywords

Biomass; COSMO RS; Ionic liquids; Solubility

Indexed keywords


EID: 84868449632     PISSN: 00959782     EISSN: None     Source Type: Journal    
DOI: 10.1007/s10953-012-9887-3     Document Type: Article
Times cited : (36)

References (33)
  • 1
    • 78650822284 scopus 로고    scopus 로고
    • Pretreatment efficiency and structural characterization of rice straw by an integrated process of dilute-acid and steam explosion for bioethanol production
    • Chen, W.H., Pen, B.L., Yu, C.T., Hwang, W.S.: Pretreatment efficiency and structural characterization of rice straw by an integrated process of dilute-acid and steam explosion for bioethanol production. Bioresour. Technol. 102, 2916-2924 (2011).
    • (2011) Bioresour. Technol. , vol.102 , pp. 2916-2924
    • Chen, W.H.1    Pen, B.L.2    Yu, C.T.3    Hwang, W.S.4
  • 2
    • 70450129261 scopus 로고    scopus 로고
    • Microwave-assisted conversion of lignocellulosic biomass into furans in ionic liquid
    • Zhang, Z., Zhao, Z.K.: Microwave-assisted conversion of lignocellulosic biomass into furans in ionic liquid. Bioresour. Technol. 101, 1111-1114 (2010).
    • (2010) Bioresour. Technol. , vol.101 , pp. 1111-1114
    • Zhang, Z.1    Zhao, Z.K.2
  • 3
    • 0035506023 scopus 로고    scopus 로고
    • Unconventional methods in cellulose functionalization
    • Heinze, T., Liebert, T.: Unconventional methods in cellulose functionalization. Prog. Polym. Sci. 26, 1689-1762 (2001).
    • (2001) Prog. Polym. Sci. , vol.26 , pp. 1689-1762
    • Heinze, T.1    Liebert, T.2
  • 4
    • 51349153711 scopus 로고    scopus 로고
    • Pretreatments to enhance the digestibility of lignocellulose biomass
    • Hendriks, A.T.W.M., Zeeman, G.: Pretreatments to enhance the digestibility of lignocellulose biomass. Bioresour. Technol. 100, 10-18 (2009).
    • (2009) Bioresour. Technol. , vol.100 , pp. 10-18
    • Hendriks, A.T.W.M.1    Zeeman, G.2
  • 5
    • 18744395820 scopus 로고    scopus 로고
    • How do lignin composition, structure, and cross-linking affect degradability? A review of cell wall model studies
    • Grabber, J.H.: How do lignin composition, structure, and cross-linking affect degradability? A review of cell wall model studies. Crop Sci. 45, 820-831 (2005).
    • (2005) Crop Sci. , vol.45 , pp. 820-831
    • Grabber, J.H.1
  • 8
    • 77950193653 scopus 로고    scopus 로고
    • Understanding the interactions of cellulose with ionic liquids: A molecular dynamics study
    • Liu, H., Sale, K.L., Holmes, B.M., Simmons, B.A., Singh, S.: Understanding the interactions of cellulose with ionic liquids: a molecular dynamics study. J. Phys. Chem. B 114, 4293-4301 (2010).
    • (2010) J. Phys. Chem. B , vol.114 , pp. 4293-4301
    • Liu, H.1    Sale, K.L.2    Holmes, B.M.3    Simmons, B.A.4    Singh, S.5
  • 9
    • 77955657002 scopus 로고    scopus 로고
    • Ionic liquids: Applications and future trends in bioreactor technology
    • Quijano, G., Couvert, A., Amrane, A.: Ionic liquids: applications and future trends in bioreactor technology. Bioresour. Technol. 101, 8923-8930 (2010).
    • (2010) Bioresour. Technol. , vol.101 , pp. 8923-8930
    • Quijano, G.1    Couvert, A.2    Amrane, A.3
  • 10
    • 18144362501 scopus 로고    scopus 로고
    • Ionic liquids: Green solvents for nonaqueous biocatalysis
    • Yang, Z., Pan, W.: Ionic liquids: green solvents for nonaqueous biocatalysis. Enzyme Microb. Technol. 37, 19-28 (2005).
    • (2005) Enzyme Microb. Technol. , vol.37 , pp. 19-28
    • Yang, Z.1    Pan, W.2
  • 11
    • 78649853498 scopus 로고    scopus 로고
    • Modelling cellulose solubilities in ionic liquids using COSMORS
    • Kahlen, J., Masuch, K., Leonhard, K.: Modelling cellulose solubilities in ionic liquids using COSMORS. Green Chem. 12, 2172-2181 (2010).
    • (2010) Green Chem. , vol.12 , pp. 2172-2181
    • Kahlen, J.1    Masuch, K.2    Leonhard, K.3
  • 12
    • 37349079223 scopus 로고    scopus 로고
    • Atomistic simulation of the thermodynamic and transport properties of ionic liquids
    • Maginn, E.: Atomistic simulation of the thermodynamic and transport properties of ionic liquids. Acc. Chem. Res. 40, 1200-1207 (2007).
    • (2007) Acc. Chem. Res. , vol.40 , pp. 1200-1207
    • Maginn, E.1
  • 13
    • 0035497999 scopus 로고    scopus 로고
    • Thermodynamic properties of mixtures containing ionic liquids. 1. Activity coefficients at infinite dilution of alkanes, alkenes, and alkylbenzenes in 4-methyln- butylpyridinium tetrafluoroborate using gas liquid chromatography
    • Heintz, A., Kulikov, D.V., Verevkin, S.P.: Thermodynamic properties of mixtures containing ionic liquids. 1. Activity coefficients at infinite dilution of alkanes, alkenes, and alkylbenzenes in 4-methyln- butylpyridinium tetrafluoroborate using gas liquid chromatography. J. Chem. Eng. Data 46, 1526- 1529 (2001).
    • (2001) J. Chem. Eng. Data , vol.46 , pp. 1526-1529
    • Heintz, A.1    Kulikov, D.V.2    Verevkin, S.P.3
  • 14
    • 68749112787 scopus 로고    scopus 로고
    • Prediction of phase equilibrium in mixtures containing ionic liquids using UNIFAC
    • Alevizou, E.I., Pappa, G.D., Voutsas, E.C.: Prediction of phase equilibrium in mixtures containing ionic liquids using UNIFAC. Fluid Phase Equilib. 284, 99-105 (2009).
    • (2009) Fluid Phase Equilib. , vol.284 , pp. 99-105
    • Alevizou, E.I.1    Pappa, G.D.2    Voutsas, E.C.3
  • 15
    • 77958512349 scopus 로고    scopus 로고
    • COSMO-RS based predictions for the desulphurization of diesel oil using ionic liquids: Effect of cation and anion combination
    • Anantharaj, R., Banerjee, T.: COSMO-RS based predictions for the desulphurization of diesel oil using ionic liquids: effect of cation and anion combination. Fuel Process. Technol. 92, 39-52 (2010).
    • (2010) Fuel Process. Technol. , vol.92 , pp. 39-52
    • Anantharaj, R.1    Banerjee, T.2
  • 16
    • 77956879222 scopus 로고    scopus 로고
    • COSMO-RS as a tool for property prediction of IL mixtures- A review
    • Diedenhofen, M., Klamt, A.: COSMO-RS as a tool for property prediction of IL mixtures-a review. Fluid Phase Equilib. 294, 31-38 (2010).
    • (2010) Fluid Phase Equilib. , vol.294 , pp. 31-38
    • Diedenhofen, M.1    Klamt, A.2
  • 17
    • 33645450745 scopus 로고    scopus 로고
    • Dissolution of cellulose with ionic liquids and its application: A mini-review
    • Zhu, S., Wu, Y., Chen, Q., Yu, Z., Wang, C., Jin, S., Ding, Y., Wu, G.: Dissolution of cellulose with ionic liquids and its application: a mini-review. Green Chem. 8, 325-327 (2006).
    • (2006) Green Chem. , vol.8 , pp. 325-327
    • Zhu, S.1    Wu, Y.2    Chen, Q.3    Yu, Z.4    Wang, C.5    Jin, S.6    Ding, Y.7    Wu, G.8
  • 18
    • 63549131316 scopus 로고    scopus 로고
    • Ionic liquid-mediated selective extraction of lignin from wood leading to enhanced enzymatic cellulose hydrolysis
    • Lee, S.H., Doherty, T.V., Linhardt, R.J., Dordick, J.S.: Ionic liquid-mediated selective extraction of lignin from wood leading to enhanced enzymatic cellulose hydrolysis. Biotechnol. Bioeng. 102, 1368-1376 (2008).
    • (2008) Biotechnol. Bioeng. , vol.102 , pp. 1368-1376
    • Lee, S.H.1    Doherty, T.V.2    Linhardt, R.J.3    Dordick, J.S.4
  • 19
    • 77953441387 scopus 로고    scopus 로고
    • The solubility parameters of ionic liquids
    • Marciniak, A.: The solubility parameters of ionic liquids. Int. J. Mol. Sci. 11, 1973-1990 (2010).
    • (2010) Int. J. Mol. Sci. , vol.11 , pp. 1973-1990
    • Marciniak, A.1
  • 20
    • 77956411893 scopus 로고    scopus 로고
    • COSMO-RS based screening of ionic liquids as green solvents in denitrification studies
    • Anantharaj, R., Banerjee, T.: COSMO-RS based screening of ionic liquids as green solvents in denitrification studies. Ind. Eng. Chem. Res. 49, 8705-8725 (2010).
    • (2010) Ind. Eng. Chem. Res. , vol.49 , pp. 8705-8725
    • Anantharaj, R.1    Banerjee, T.2
  • 22
    • 5944261746 scopus 로고
    • Density functional approximation for the correlation energy of the inhomogeneous electron gas
    • Perdew, J.P.: Density functional approximation for the correlation energy of the inhomogeneous electron gas. Phys. Rev. B 33, 8822-8824 (1986).
    • (1986) Phys. Rev. B , vol.33 , pp. 8822-8824
    • Perdew, J.P.1
  • 23
    • 0039209924 scopus 로고
    • Fully optimized contracted Gaussian basis sets of triple zeta valence quality for atoms Li to Kr
    • Schafer, A., Huber, C., Ahlrichs, R.: Fully optimized contracted Gaussian basis sets of triple zeta valence quality for atoms Li to Kr. J. Chem. Phys. 100, 5829-5835 (1994).
    • (1994) J. Chem. Phys. , vol.100 , pp. 5829-5835
    • Schafer, A.1    Huber, C.2    Ahlrichs, R.3
  • 25
    • 0001645699 scopus 로고
    • A local density functional study of the structure and vibrational frequencies of molecular transition-metal compounds
    • Sosa, C., Andzelm, J., Elkin, B.C., Wimmer, E., Dobbs, K.D., Dixon, D.A.: A local density functional study of the structure and vibrational frequencies of molecular transition-metal compounds. J. Phys. Chem. 96, 6630-6636 (1992).
    • (1992) J. Phys. Chem. , vol.96 , pp. 6630-6636
    • Sosa, C.1    Andzelm, J.2    Elkin, B.C.3    Wimmer, E.4    Dobbs, K.D.5    Dixon, D.A.6
  • 26
    • 84961985847 scopus 로고    scopus 로고
    • Quantum calculation of molecular energies and energy gradients in solution by a conductor solvent model
    • Barone, V., Cossi, M.: Quantum calculation of molecular energies and energy gradients in solution by a conductor solvent model. J. Phys. Chem. A 102, 1995-2001 (1998).
    • (1998) J. Phys. Chem. A , vol.102 , pp. 1995-2001
    • Barone, V.1    Cossi, M.2
  • 27
    • 0034725477 scopus 로고    scopus 로고
    • COSMO-RS: A novel and efficient method for the a priori prediction of thermo physical data of liquids
    • Klamt, A., Eckert, F.: COSMO-RS: a novel and efficient method for the a priori prediction of thermo physical data of liquids. Fluid Phase Equilib. 172, 43-72 (2000).
    • (2000) Fluid Phase Equilib. , vol.172 , pp. 43-72
    • Klamt, A.1    Eckert, F.2
  • 28
    • 33847666435 scopus 로고    scopus 로고
    • Multicomponent liquid-liquid equilibria prediction for aromatic extraction systems using COSMO-RS
    • Banerjee, T., Sahoo, R.K., Rath, S.S., Kumar, R., Khanna, A.: Multicomponent liquid-liquid equilibria prediction for aromatic extraction systems using COSMO-RS. Ind. Eng. Chem. Res. 46, 1292-1304 (2007).
    • (2007) Ind. Eng. Chem. Res. , vol.46 , pp. 1292-1304
    • Banerjee, T.1    Sahoo, R.K.2    Rath, S.S.3    Kumar, R.4    Khanna, A.5
  • 29
    • 47549085630 scopus 로고    scopus 로고
    • Liquid-liquid equilibrium for ionic liquid systems using COSMO-RS: Effect of cation and anion dissociation
    • Banerjee, T., Verma, K.K., Khanna, A.: Liquid-liquid equilibrium for ionic liquid systems using COSMO-RS: effect of cation and anion dissociation. AIChE J. 54, 1874-1885 (2008).
    • (2008) AIChE J. , vol.54 , pp. 1874-1885
    • Banerjee, T.1    Verma, K.K.2    Khanna, A.3
  • 30
    • 33646521298 scopus 로고    scopus 로고
    • Prediction of binary VLE for imidazolium based ionic liquid systems using COSMO-RS
    • Banerjee, T., Singh, M.K., Khanna, A.: Prediction of binary VLE for imidazolium based ionic liquid systems using COSMO-RS. Ind. Eng. Chem. Res. 45, 3207-3219 (2006).
    • (2006) Ind. Eng. Chem. Res. , vol.45 , pp. 3207-3219
    • Banerjee, T.1    Singh, M.K.2    Khanna, A.3
  • 31
    • 33845323784 scopus 로고    scopus 로고
    • Infinite dilution activity coefficients for trihexyltetradecyl phosphonium ionic liquids: Measurements and COSMO-RS prediction
    • Banerjee, T., Khanna, A.: Infinite dilution activity coefficients for trihexyltetradecyl phosphonium ionic liquids: measurements and COSMO-RS prediction. J. Chem. Eng. Data 51, 2170-2177 (2006).
    • (2006) J. Chem. Eng. Data , vol.51 , pp. 2170-2177
    • Banerjee, T.1    Khanna, A.2
  • 32
    • 0033860128 scopus 로고    scopus 로고
    • Controlled release of a herbicide from matrix granules based on solventfractionated organosolv lignins
    • Zhao, J., Wilkins, R.M.: Controlled release of a herbicide from matrix granules based on solventfractionated organosolv lignins. J. Agric. Food Chem. 48, 3651-3661 (2000).
    • (2000) J. Agric. Food Chem. , vol.48 , pp. 3651-3661
    • Zhao, J.1    Wilkins, R.M.2
  • 33
    • 23044507145 scopus 로고    scopus 로고
    • The Hildebrand solubility parameters, cohesive energy densities and internal energies of 1-alkyl-3-methylimidazolium-based room temperature ionic liquids
    • Lee, S.H., Lee, S.B.: The Hildebrand solubility parameters, cohesive energy densities and internal energies of 1-alkyl-3-methylimidazolium-based room temperature ionic liquids. Chem. Commun., 3469- 3471 (2005).
    • (2005) Chem. Commun. , pp. 3469-3471
    • Lee, S.H.1    Lee, S.B.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.