Existence and regularity of solutions to model for liquid mixture of 3He-4He is considered in this paper. First, it is proved that this system possesses a unique global weak solution in H^1 (Ω, C ×R) by using ...Existence and regularity of solutions to model for liquid mixture of 3He-4He is considered in this paper. First, it is proved that this system possesses a unique global weak solution in H^1 (Ω, C ×R) by using Galerkin method. Secondly, by using an iteration procedure, regularity estimates for the linear semigroups, it is proved that the model for liquid mixture of 3He-4He has a unique solution in H^k(Ω, C × R) for all k ≥ 1.展开更多
A new equation for predicting surface tension is proposed based on the thermodynamic definition of surface tension and the expression of the Gibbs free energy of the system. Using the NRTL equation to represent the ex...A new equation for predicting surface tension is proposed based on the thermodynamic definition of surface tension and the expression of the Gibbs free energy of the system. Using the NRTL equation to represent the excess Gibbs free energy, a two-parameter surface tension equation is derived. The feasibility of the new equation has been tested in terms of 124 binary and 16 multicomponent systems(13-ternary and 3-quaternary) with absolute relative deviations of 0.59% and 1.55% respectively. This model is also predictive for the temperature dependence of surface tension of liquid mixtures. It is shown that, with good accuracy, this equation is simple and reliable for practical use.展开更多
Based on Schaaff's collision factor theory (CFT) in liquids, the equations for nonlinear ultrasonic parameters in both organic liquid and binary organic liquid mixtures are deduced. The nonlinear ultrasonic paramet...Based on Schaaff's collision factor theory (CFT) in liquids, the equations for nonlinear ultrasonic parameters in both organic liquid and binary organic liquid mixtures are deduced. The nonlinear ultrasonic parameters, including pressure coefficient, temperature coefficients of ultrasonic velocity, and nonlinear acoustic parameter B/A in both organic liquid and binary organic liquid mixtures, are evaluated for comparison with the measured results and data from other sources. The equations show that the coefficient of ultrasonic velocity and nonlinear acoustic parameter B/A are closely related to molecular interactions. These nonlinear ultrasonic parameters reflect some information of internal structure and outside status of the medium or mixtures. From the exponent of repulsive forces of the molecules, several thermodynamic parameters, pressure and temperature of the medium, the nonlinear ultrasonic parameters and ultrasonic nature of the medium can be evaluated. When evaluating and studying nonlinear acoustic parameter B/A of binary organic liquid mixtures, there is no need to know the nonlinear acoustic parameter B/A of the components. Obviously, the equation reveals the connection between the nonlinear ultrasonic nature and internal structure and outside status of the mixtures more directly and distinctly than traditional mixture law for B/A, e.g. Apfel's and Sehgal's laws for liquid binary mixtures.展开更多
In order to improve the performance of the two-cell stimulated Brillouin scattering (SBS) system, this paper proposes the methods of using mixtures, which require amplifier media to have small absorption rate, and g...In order to improve the performance of the two-cell stimulated Brillouin scattering (SBS) system, this paper proposes the methods of using mixtures, which require amplifier media to have small absorption rate, and generator media to have high optical breakdown threshold and Brillouin frequency shift equal to that of the amplification media. The characteristics of the two-cell SBS system are studied experimentally by using CCl4 as amplifier medium and CCl4, C2H5OH and CCl4/C2H5OH liquid mixture as generator medium pumped by Nd:YAG Q-switched laser. The obtained results show that liquid mixture in generator cell improves the power load ability, phase conjugation fidelity, energy reflectivity (ER) and ER stability.展开更多
Disk-like liquid crystals(DLCs) can self-assemble to ordered columnar mesophases and are intriguing onedimensional organic semiconductors with high charge carrier mobility.To improve their applicable property of mes...Disk-like liquid crystals(DLCs) can self-assemble to ordered columnar mesophases and are intriguing onedimensional organic semiconductors with high charge carrier mobility.To improve their applicable property of mesomorphic temperature ranges,we exploit the binary mixtures of electronic donor-acceptor DLC materials.The electron-rich2,3,6,7,10,11-hexakis(alkoxy)triphenylenes(C4,C6,C8,C10,C12) and an electron-deficient tetrapentyl triphenylene-2,3,6,10-tetracarboxylate have been prepared and their binary mixtures have been investigated.The mesomorphism of the1:1(molar ratio) mixtures has been characterized by polarizing optical microscopy(POM),differential scanning calorimetry(DSC),and small angel x-ray scattering(SAXS).The self-assembled monolayer structure of a discogen on a solid-liquid interface has been imaged by the high resolution scanning tunneling microscopy(STM).The match of peripheral chain length has important influence on the mesomorphism of the binary mixtures.展开更多
Thermodynamic and chemical properties of liquid carbon dioxide and nitrogen(CO_(2~–)N_2) mixture under the conditions of extremely high densities and temperatures are studied by using quantum molecular dynamic(...Thermodynamic and chemical properties of liquid carbon dioxide and nitrogen(CO_(2~–)N_2) mixture under the conditions of extremely high densities and temperatures are studied by using quantum molecular dynamic(QMD) simulations based on density functional theory including dispersion corrections(DFT-D). We present equilibrium properties of liquid mixture for 112 separate density and temperature points, by selecting densities ranging from ρ = 1.80 g/cm^3 to 3.40 g/cm^3 and temperatures from T = 500 K to 8000 K. In the range of our study, the liquid CO_(2~–)N_2 mixture undergoes a continuous transition from molecular to atomic fluid state and liquid polymerization inferred from pair correlation functions(PCFs)and the distribution of various molecular components. The insulator–metal transition is demonstrated by means of the electronic density of states(DOS).展开更多
Physical properties including refractive index, density, viscosity and conductivity for binary mixtures of l-butyl- 3-methyl imidazolium chloride ([BMIM]CI) and different organic solvents at 298.15 K have been inves...Physical properties including refractive index, density, viscosity and conductivity for binary mixtures of l-butyl- 3-methyl imidazolium chloride ([BMIM]CI) and different organic solvents at 298.15 K have been investigated. Ex- cess molar volumes have been calculated and obtained data has been fitted by the Redlich-Kister equation. The density and refractive index were found to increase with increasing concentration of [BMIM]CI, however, excep- tions do exist as in the case of dimethyl sulfoxide (DMSO)/[BMIM]CI. For DMSO/[BMIM]CI, the density decreases with increasing concentration. The addition of different organic solvents was able to disrupt the interactions within mixtures, leading to free mobility of ions. The free mobility of ions has been found to enhance conductivity and decrease viscosity to varying extents in all mixtures studied. It has been observed that solubility parameters, dielectric constants and composition of the solvents used play a vital role in determining the resultant properties. The data obtained will play an important role in understanding the effect of the addition of organic solvents in ILs to enhance their applicability.展开更多
The present work uses the concept of a scaled particle along with the perturbation and variation approach, to develop an equation of state (EOS) for a mixture of hard sphere (HS), Lennar-Jones (L J) fluids. A su...The present work uses the concept of a scaled particle along with the perturbation and variation approach, to develop an equation of state (EOS) for a mixture of hard sphere (HS), Lennar-Jones (L J) fluids. A suitable flexible functional form for the radial distribution function G(R) is assumed for the mixture, with R as a variable. The function G(R) has an arbitrary parameter m and a different equation of state can be obtained with a suitable choice of m. For m = 0.75 and m = 0.83 results are close to molecular dynamics (MD) result for pure HS and LJ fluid respectively.展开更多
In this paper, we employ the concept of probability for creating a cavity with diameter d in fluid along with the perturbation and variation approach, and develop an equation of state (EOS) for a hard sphere (HS) ...In this paper, we employ the concept of probability for creating a cavity with diameter d in fluid along with the perturbation and variation approach, and develop an equation of state (EOS) for a hard sphere (HS) and Lennard Jones (L J) fluids. A suitable axiomatic form for surface tension S(r) is assumed for the pure fluid, with r as a variable. The function S(r) has an arbitrary parameter rn. S(r) = A + B(d/r)/[1 + m(d/r)]. We use the condition in terms of radial distribution function G(λd,η) containing the self-consistent parameter λ and the condition of continuity at r = d/2 to determine A and B. A different EOS can be obtained with a suitable choice of rn and the EOS has a lower root-mean-square deviation than that of Barker-Henderson BH2 for LJ fluids.展开更多
In order to measure the Brillouin frequency shift (BFS) of the medium, this paper proposes a method using mixtures in a two-cell stimulated Brillouin scattering system, which uses a medium to be measured as amplifie...In order to measure the Brillouin frequency shift (BFS) of the medium, this paper proposes a method using mixtures in a two-cell stimulated Brillouin scattering system, which uses a medium to be measured as amplifier medium and a mixture medium as generator medium. The seed light from the generator gains effective amplification in the amplifier and the amplification ratio changes with the mixing fraction, Only when the BFS of the mixture medium is equal to that of the medium in the amplifier does the seed light obtain the maximum amplification ratio. The method has the advantage of independence of the wavelength of the incident light.展开更多
In order to understand the interactions of the mixtures of ionic liquids with different organic solvents,density,conductivity and refractive index have been investigated for binary mixtures of 1-allyl-3-methyl-imidazo...In order to understand the interactions of the mixtures of ionic liquids with different organic solvents,density,conductivity and refractive index have been investigated for binary mixtures of 1-allyl-3-methyl-imidazolium chloride( [AMIM]Cl) with acetonitrile,ethanol,and dimethyl sulfoxide( DMSO) at 298. 15 K. Density and refractive index were found to increase with increasing [AMIM]Cl concentration. Conductivity was found to increase initially by the addition of [AMIM]Cl. However,as the amount of [AMIM]Cl increases,a gradual decrease in conductivity of the mixtures has been observed. The resultant properties were caused by subsequent ion-ion and / or ion-solvent interactions depending on the extent of polarity,dielectric constants and miscibility of organic solvents being used.展开更多
In this work, the mesophase properties were tuned via mixing two discotic molecules with structural complementarity. Compared with the liquid crystalline hexakis(n-hexyloxy)triphenylene(H6TP)materials(columnar he...In this work, the mesophase properties were tuned via mixing two discotic molecules with structural complementarity. Compared with the liquid crystalline hexakis(n-hexyloxy)triphenylene(H6TP)materials(columnar hexagonal phase from 53 ℃ to 91 ℃), mesophase types as well as phase transition temperatures varied with the introduction of crystalline hexaazatriphenylene derivative(PBH)molecules. The introduction of less than 33% amount of PBH disrupted the columnar hexagonal phase formed by H6 TP remarkably, followed by the decreased clearing temperatures of liquid crystals. As the PBH amount was further increased, the destroyed columnar hexagonal phase was turned into the columnar rectangular phase, in which H6 TP and PBH molecules together formed the columnar mesophase. The formation of new mesophase contributed to the enlarged mesophase temperature(from44 ℃ to 144 ℃). We speculated that the alkyl chains interaction induced by the PBH component competed with the strong p–p stacking between H6 TP molecules, thus altering the liquid crystalline properties including mesophase types and phase transition temperatures.展开更多
Molecular dynamics (MD) computer simulation techniques, as a powerful tool commonly utilized by the liquid crystal display (LCD) community, usually are employed for computing the equilibrium and transport properti...Molecular dynamics (MD) computer simulation techniques, as a powerful tool commonly utilized by the liquid crystal display (LCD) community, usually are employed for computing the equilibrium and transport properties of a classical many body system, since they are very similar to real experiments in many respects. In this paper we pre- sent molecular dynamics computer simulation results taken for a mixture of the two different kinds of nematic liq- uid crystals (LCs). We calculated rotational viscosity from Brownian behavior with friction of the mean director of the mixture comprising pentylcyanobiphenol (5CB) and decylcyanobiphenol (10CB) by using molecular dynamics computer simulation, where intermolecular potential parameter is Generalized AMBER force field (GAFF). Our computed results show a good agreement with the experimental results.展开更多
基金Sponsored by the National Natural Science Foundation of China(11071177)NSF of Sichuan Science and Technology Department of China(2010JY0057)the NSF of Sichuan Education Department of China(11ZA102)
文摘Existence and regularity of solutions to model for liquid mixture of 3He-4He is considered in this paper. First, it is proved that this system possesses a unique global weak solution in H^1 (Ω, C ×R) by using Galerkin method. Secondly, by using an iteration procedure, regularity estimates for the linear semigroups, it is proved that the model for liquid mixture of 3He-4He has a unique solution in H^k(Ω, C × R) for all k ≥ 1.
基金the Scientific Research Foundation of the State Education Ministry for Returned Overseas Chinese Scholar.
文摘A new equation for predicting surface tension is proposed based on the thermodynamic definition of surface tension and the expression of the Gibbs free energy of the system. Using the NRTL equation to represent the excess Gibbs free energy, a two-parameter surface tension equation is derived. The feasibility of the new equation has been tested in terms of 124 binary and 16 multicomponent systems(13-ternary and 3-quaternary) with absolute relative deviations of 0.59% and 1.55% respectively. This model is also predictive for the temperature dependence of surface tension of liquid mixtures. It is shown that, with good accuracy, this equation is simple and reliable for practical use.
文摘Based on Schaaff's collision factor theory (CFT) in liquids, the equations for nonlinear ultrasonic parameters in both organic liquid and binary organic liquid mixtures are deduced. The nonlinear ultrasonic parameters, including pressure coefficient, temperature coefficients of ultrasonic velocity, and nonlinear acoustic parameter B/A in both organic liquid and binary organic liquid mixtures, are evaluated for comparison with the measured results and data from other sources. The equations show that the coefficient of ultrasonic velocity and nonlinear acoustic parameter B/A are closely related to molecular interactions. These nonlinear ultrasonic parameters reflect some information of internal structure and outside status of the medium or mixtures. From the exponent of repulsive forces of the molecules, several thermodynamic parameters, pressure and temperature of the medium, the nonlinear ultrasonic parameters and ultrasonic nature of the medium can be evaluated. When evaluating and studying nonlinear acoustic parameter B/A of binary organic liquid mixtures, there is no need to know the nonlinear acoustic parameter B/A of the components. Obviously, the equation reveals the connection between the nonlinear ultrasonic nature and internal structure and outside status of the mixtures more directly and distinctly than traditional mixture law for B/A, e.g. Apfel's and Sehgal's laws for liquid binary mixtures.
基金Project supported by the National Natural Science Foundation of China (Grant Nos 10476009 and 60478020), and the China Postdoctoral Science Foundation (Grant No 20060390795) and by program of Excellent team in Harbin Institute of Technology, China.
文摘In order to improve the performance of the two-cell stimulated Brillouin scattering (SBS) system, this paper proposes the methods of using mixtures, which require amplifier media to have small absorption rate, and generator media to have high optical breakdown threshold and Brillouin frequency shift equal to that of the amplification media. The characteristics of the two-cell SBS system are studied experimentally by using CCl4 as amplifier medium and CCl4, C2H5OH and CCl4/C2H5OH liquid mixture as generator medium pumped by Nd:YAG Q-switched laser. The obtained results show that liquid mixture in generator cell improves the power load ability, phase conjugation fidelity, energy reflectivity (ER) and ER stability.
基金Project supported by the National Natural Science Foundation of China(Grant Nos.51273133 and 51443004)
文摘Disk-like liquid crystals(DLCs) can self-assemble to ordered columnar mesophases and are intriguing onedimensional organic semiconductors with high charge carrier mobility.To improve their applicable property of mesomorphic temperature ranges,we exploit the binary mixtures of electronic donor-acceptor DLC materials.The electron-rich2,3,6,7,10,11-hexakis(alkoxy)triphenylenes(C4,C6,C8,C10,C12) and an electron-deficient tetrapentyl triphenylene-2,3,6,10-tetracarboxylate have been prepared and their binary mixtures have been investigated.The mesomorphism of the1:1(molar ratio) mixtures has been characterized by polarizing optical microscopy(POM),differential scanning calorimetry(DSC),and small angel x-ray scattering(SAXS).The self-assembled monolayer structure of a discogen on a solid-liquid interface has been imaged by the high resolution scanning tunneling microscopy(STM).The match of peripheral chain length has important influence on the mesomorphism of the binary mixtures.
基金Project supported by the National Natural Science Foundation of China(Grant Nos.11374217,11135012,and 11375262)the Joint Fund of the National Natural Science Foundation of Chinathe China Academy of Engineering Physics(Grant No.11176020)
文摘Thermodynamic and chemical properties of liquid carbon dioxide and nitrogen(CO_(2~–)N_2) mixture under the conditions of extremely high densities and temperatures are studied by using quantum molecular dynamic(QMD) simulations based on density functional theory including dispersion corrections(DFT-D). We present equilibrium properties of liquid mixture for 112 separate density and temperature points, by selecting densities ranging from ρ = 1.80 g/cm^3 to 3.40 g/cm^3 and temperatures from T = 500 K to 8000 K. In the range of our study, the liquid CO_(2~–)N_2 mixture undergoes a continuous transition from molecular to atomic fluid state and liquid polymerization inferred from pair correlation functions(PCFs)and the distribution of various molecular components. The insulator–metal transition is demonstrated by means of the electronic density of states(DOS).
基金the National Natural Science Foundation of China(51273041)
文摘Physical properties including refractive index, density, viscosity and conductivity for binary mixtures of l-butyl- 3-methyl imidazolium chloride ([BMIM]CI) and different organic solvents at 298.15 K have been investigated. Ex- cess molar volumes have been calculated and obtained data has been fitted by the Redlich-Kister equation. The density and refractive index were found to increase with increasing concentration of [BMIM]CI, however, excep- tions do exist as in the case of dimethyl sulfoxide (DMSO)/[BMIM]CI. For DMSO/[BMIM]CI, the density decreases with increasing concentration. The addition of different organic solvents was able to disrupt the interactions within mixtures, leading to free mobility of ions. The free mobility of ions has been found to enhance conductivity and decrease viscosity to varying extents in all mixtures studied. It has been observed that solubility parameters, dielectric constants and composition of the solvents used play a vital role in determining the resultant properties. The data obtained will play an important role in understanding the effect of the addition of organic solvents in ILs to enhance their applicability.
文摘The present work uses the concept of a scaled particle along with the perturbation and variation approach, to develop an equation of state (EOS) for a mixture of hard sphere (HS), Lennar-Jones (L J) fluids. A suitable flexible functional form for the radial distribution function G(R) is assumed for the mixture, with R as a variable. The function G(R) has an arbitrary parameter m and a different equation of state can be obtained with a suitable choice of m. For m = 0.75 and m = 0.83 results are close to molecular dynamics (MD) result for pure HS and LJ fluid respectively.
文摘In this paper, we employ the concept of probability for creating a cavity with diameter d in fluid along with the perturbation and variation approach, and develop an equation of state (EOS) for a hard sphere (HS) and Lennard Jones (L J) fluids. A suitable axiomatic form for surface tension S(r) is assumed for the pure fluid, with r as a variable. The function S(r) has an arbitrary parameter rn. S(r) = A + B(d/r)/[1 + m(d/r)]. We use the condition in terms of radial distribution function G(λd,η) containing the self-consistent parameter λ and the condition of continuity at r = d/2 to determine A and B. A different EOS can be obtained with a suitable choice of rn and the EOS has a lower root-mean-square deviation than that of Barker-Henderson BH2 for LJ fluids.
基金Project supported by the National Natural Science Foundation of China (Grant Nos 10476009 and 60478020).
文摘In order to measure the Brillouin frequency shift (BFS) of the medium, this paper proposes a method using mixtures in a two-cell stimulated Brillouin scattering system, which uses a medium to be measured as amplifier medium and a mixture medium as generator medium. The seed light from the generator gains effective amplification in the amplifier and the amplification ratio changes with the mixing fraction, Only when the BFS of the mixture medium is equal to that of the medium in the amplifier does the seed light obtain the maximum amplification ratio. The method has the advantage of independence of the wavelength of the incident light.
基金National Natural Science Foundation of China(No.51273041)
文摘In order to understand the interactions of the mixtures of ionic liquids with different organic solvents,density,conductivity and refractive index have been investigated for binary mixtures of 1-allyl-3-methyl-imidazolium chloride( [AMIM]Cl) with acetonitrile,ethanol,and dimethyl sulfoxide( DMSO) at 298. 15 K. Density and refractive index were found to increase with increasing [AMIM]Cl concentration. Conductivity was found to increase initially by the addition of [AMIM]Cl. However,as the amount of [AMIM]Cl increases,a gradual decrease in conductivity of the mixtures has been observed. The resultant properties were caused by subsequent ion-ion and / or ion-solvent interactions depending on the extent of polarity,dielectric constants and miscibility of organic solvents being used.
基金supported by the National Natural Science Foundation of China(No.51303177)the Strategic Priority Research Program of the Chinese Academy of Sciences(No.XDB12020300)
文摘In this work, the mesophase properties were tuned via mixing two discotic molecules with structural complementarity. Compared with the liquid crystalline hexakis(n-hexyloxy)triphenylene(H6TP)materials(columnar hexagonal phase from 53 ℃ to 91 ℃), mesophase types as well as phase transition temperatures varied with the introduction of crystalline hexaazatriphenylene derivative(PBH)molecules. The introduction of less than 33% amount of PBH disrupted the columnar hexagonal phase formed by H6 TP remarkably, followed by the decreased clearing temperatures of liquid crystals. As the PBH amount was further increased, the destroyed columnar hexagonal phase was turned into the columnar rectangular phase, in which H6 TP and PBH molecules together formed the columnar mesophase. The formation of new mesophase contributed to the enlarged mesophase temperature(from44 ℃ to 144 ℃). We speculated that the alkyl chains interaction induced by the PBH component competed with the strong p–p stacking between H6 TP molecules, thus altering the liquid crystalline properties including mesophase types and phase transition temperatures.
文摘Molecular dynamics (MD) computer simulation techniques, as a powerful tool commonly utilized by the liquid crystal display (LCD) community, usually are employed for computing the equilibrium and transport properties of a classical many body system, since they are very similar to real experiments in many respects. In this paper we pre- sent molecular dynamics computer simulation results taken for a mixture of the two different kinds of nematic liq- uid crystals (LCs). We calculated rotational viscosity from Brownian behavior with friction of the mean director of the mixture comprising pentylcyanobiphenol (5CB) and decylcyanobiphenol (10CB) by using molecular dynamics computer simulation, where intermolecular potential parameter is Generalized AMBER force field (GAFF). Our computed results show a good agreement with the experimental results.