scholarly journals Energy Disorder in Liquid Fe-Si Alloy

2011 ◽  
Vol 1 ◽  
pp. 37-40
Author(s):  
D. Adhikari ◽  
I. S. Jha ◽  
B. P. Singh
Keyword(s):  
Pairwise Interaction ◽  
Heat Of Mixing ◽  
Interaction Energies ◽  
Molten State ◽  
Energy Disorder ◽  
Energy Of Mixing ◽  
Free Energy Of Mixing ◽  
Alloy Clusters ◽  
Associated Solution Model ◽  
Associated Solution

The observed asymmetry in the properties of mixing of Fe-Si alloy in molten state is successfully explained on the basis of regular associated solution model. We have determined the free energy of mixing, heat of mixing and entropy of mixing of Fe-Si alloys in molten state at 1873 K. The analysis suggests that heterocoordination leading to the formation of complex Fe 2Si is likely to exist in the liquid and is of a strongly interacting nature. The theoretical analysis reveals that the pairwise interaction energies between the species depend considerably on temperature.Keywords: Liquid alloy; Clusters; Thermodynamic propertiesThe Himalayan Physics Vol.1, No.1, May, 2010Page: 37-40Uploaded Date: 28 July, 2011

scholarly journals Regular Associated Solution Model for the Estimation of Heat of Mixing of Binary Liquid Alloys

BIBECHANA ◽  
1970 ◽  
Vol 6 ◽  
pp. 1-8
Author(s):  
D Adhikari ◽  
BP Singh ◽  
IS Jha
Keyword(s):  
Equilibrium Constants ◽  
Pairwise Interaction ◽  
Solution Model ◽  
Heat Of Mixing ◽  
Interaction Energies ◽  
Binary Liquid ◽  
Energy Of Mixing ◽  
Free Energy Of Mixing ◽  
Associated Solution Model ◽  
Associated Solution

We have determined the equilibrium constants and pairwise interaction energies between the species and the complexes of liquid CuSn, AgAl and FeSi, alloys on the basis of regular associated solution model. These parameters are then used to estimate the heat of mixing of each alloy. The observed asymmetry in the heat of mixing of each alloy with respect to concentration is well explained. Key Words: Free energy of mixing; Asymmetry; Binary alloys, interaction energyThe corrected version of this PDF was loaded on 8/12/2010.DOI: 10.3126/bibechana.v6i0.3931BIBECHANA Vol. 6, March 2010 pp.1-8

scholarly journals Regular Associated Solution Model for the Estimation of Free Energy of Mixing of Binary Liquid Alloys

1970 ◽  
Vol 8 (8) ◽  
pp. 30-33
Author(s):  
D Adhikari ◽  
BP Singh ◽  
IS Jha
Keyword(s):  
Free Energy ◽  
Equilibrium Constants ◽  
Solution Model ◽  
Interaction Energies ◽  
Free Energies ◽  
Scientific World ◽  
Energy Of Mixing ◽  
Free Energy Of Mixing ◽  
Associated Solution Model ◽  
Associated Solution

We have found the equilibrium constants and pairwise interaction energies between the species and the complexes of liquid CuSn, AgAl, FeSi, CdNa and HgNa alloys on the basis of regular associated solution model. These parameters are then used to estimate the free energies of mixing of each alloy. The observed asymmetry in the free energy of mixing of each alloy with respect to concentration is well explained. Key Words: Free energy of mixing; Asymmetry; Binary alloys; Interaction energy. DOI: 10.3126/sw.v8i8.3842 Scientific World Vol.8(8) 2010 pp.30-33

scholarly journals Thermodynamic and structural properties of Mg-Tl liquid alloy

BIBECHANA ◽  
2012 ◽  
Vol 8 ◽  
pp. 81-89 ◽  
Author(s):  
BP Singh ◽  
D Adhikari ◽  
IS Jha ◽  
BC Kumar ◽  
SK Chaudhary ◽  
...  
Keyword(s):  
Short Range ◽  
Enthalpy Of Mixing ◽  
Mixing Enthalpy ◽  
Mixing Properties ◽  
Long Wavelength ◽  
Energy Of Mixing ◽  
Chemical Complex ◽  
Free Energy Of Mixing ◽  
Associated Solution Model ◽  
Associated Solution

The concentration dependent asymmetry in mixing properties of Mg-Tl liquid alloys at 923 K has been investigated on the basis of regular associated solution model. The concentration of ApB type complex in a regular associated solution of Mg and Tl have been determined. We have then used the concentration of complex to calculate the free energy of mixing, enthalpy of mixing, entropy of mixing, activity, concentration fluctuations in long wavelength limit SCC(0) and the Warren Cowley short-range parameter 1 α .The analysis suggests that heterocoordination leading to the formation of chemical complex Mg2Tl is likely to exist in the melt. The analysis reveals that there is a tendency of unlike atom pairing (Mg-Tl) in Mg-Tl alloy whole range of concentration.Keywords: Mg-Tl alloy; microscopic structure; pairwise interaction energy; chemical short range orderDOI: http://dx.doi.org/10.3126/bibechana.v8i0.5692BIBECHANA 8 (2012) 81-89

scholarly journals Hetero-Coordination in Liquid Pb-K Alloys

2015 ◽  
Vol 5 ◽  
pp. 87-90
Author(s):  
B. P. Singh ◽  
I. S. Jha ◽  
I. Koirala
Keyword(s):  
Enthalpy Of Mixing ◽  
Chemical Activity ◽  
Mixing Enthalpy ◽  
Interaction Energies ◽  
Molten State ◽  
Energy Of Mixing ◽  
Frame Work ◽  
Free Energy Of Mixing ◽  
Constituent Atom ◽  
Good Agreement

The observed asymmetry in properties of mixing of Pb-K alloys in the molten state is successfully explained on the basis of the quasi-lattice model. The thermodynamic functions such as free energy of mixing, enthalpy of mixing, entropy of mixing and chemical activity of the constituent atom of the alloys have been computed within the frame work of presented model. Most of the computed values are in good agreement with the experimental data. The pair-wise interaction energies between the species of the melt are found to depend considerably on temperature. Theoretical analysis suggests that hetero-coordination leading to the formation of complex Pb2K is likely to exist but is of weakly interacting in nature. The Himalayan Physics Vol. 5, No. 5, Nov. 2014 Page: 82-86

scholarly journals Theoretical assessment on hetero-coordination of Alloys Silver-Antimony at Molten State

2020 ◽  
pp. 68-73
Author(s):  
Narayan Panthi ◽  
Indra Bahadur Bhandari ◽  
Ishwar Koirala
Keyword(s):  
Reasonable Agreement ◽  
Chemical Activity ◽  
Heat Of Mixing ◽  
Thermodynamic Quantities ◽  
Molten State ◽  
Energy Of Mixing ◽  
Interchange Energy ◽  
Free Energy Of Mixing ◽  
Experimental Values ◽  
Theoretical Assessment

The thermodynamic and structural properties of binary alloy Ag- Sb at temperature 1250K have been reported theoretically using quasi lattice model. The interchange energy has been considered a function of a temperature and thus various thermodynamic quantities are calculated at elevated temperature. The theoretical values of free energy of mixing, heat of mixing, entropy of mixing and chemical activity are reasonable agreement with experimental values in all concentrations of antimony from 0.1 to 0.9. The theoretical analysis tells that the alloy shows both ordering nature in Ag rich end and segregating nature in Sb rich end .The study reveals that the properties of alloy are asymmetric around equi-atomic composition. The Ag_3 Sn complexes are most likely to exist in the liquid state and are moderately interacting.

scholarly journals Theoretical Modeling to Predict the Thermodynamic, Structural, Surface and Transport Properties of the Liquid Tl−Na Alloys at different Temperatures

2017 ◽  
Vol 4 (1) ◽  
pp. 101
Author(s):  
S. K. Yadav ◽  
L. N. Jha ◽  
D. Adhikari
Keyword(s):  
Structural Properties ◽  
Theoretical Modeling ◽  
Intrinsic Diffusion ◽  
Long Wavelength ◽  
Energy Of Mixing ◽  
Different Temperatures ◽  
Structural Surface ◽  
Free Energy Of Mixing ◽  
Associated Solution Model ◽  
Associated Solution

<p>Theoretical modeling equations are developed by extending regular associated solution model to predict the thermodynamic and structural properties of the liquid Tl−Na alloys at higher temperatures. The thermodynamic properties have been predicted by computing activities of unassociated monomers (a<sub>Tl</sub> and a<sub>Na</sub>) and free energy of mixing (G<sub>M</sub>) at temperatures 673 K, 773 K, 873 K and 973 K. The structural properties have been predicted by computing concentration fluctuation in long wavelength limit (S<sub>CC</sub>(0)), short range order parameter (α<sub>1</sub>) and ratio of mutual to intrinsic diffusion coefficients (D<sub>M</sub>/D<sub>id</sub>) at aforementioned temperatures. These properties have been then correlated with the modified Butler's model to predict the surface properties, such as surface concentrations of free monomers (X<sup>S</sup><sub>Tl</sub> and X<sup>S</sup><sub>Na</sub>) and surface tension (σ) of the alloy at above mentioned temperatures.</p><p><strong>Journal of Nepal Physical Society</strong><em><br /></em>Volume 4, Issue 1, February 2017, Page: 101-110</p>

Study of Structural Behavior of Cadmium Based Alloys at Molten State

2021 ◽  
Vol 7 (2) ◽  
Author(s):  
G. Shrestha ◽  
I. Koirala
Keyword(s):  
Thermodynamic Functions ◽  
Structural Behavior ◽  
Heat Of Mixing ◽  
Molten State ◽  
Long Wavelength ◽  
Structural Functions ◽  
Energy Of Mixing ◽  
Interchange Energy ◽  
Free Energy Of Mixing ◽  
Experimental Values

The simple statistical model or simple theory of mixing has been used to study the structural behavior of cadmium based alloys at their molten state at a temperature of 800 K by computing thermodynamic functions and structural functions. The thermodynamic functions include free energy of mixing (GM), activity (a), the heat of mixing (HM), and the entropy of mixing (SM). The structural functions include concentration fluctuation in the long-wavelength limit (SGG(0)) and Warren-Cowley short-range order parameter (α1). Interchange energy or interaction energy or ordering energy (ω) was calculated for the respective alloys system and found to be positive and temperature-dependent. Based on interchange energy (ω) and coordination number (Z), theoretical values of all the functions are calculated by applying the grand partition function. All the computed values for the mentioned functions are in good agreement with experimental values. For the cadmium based alloys, viz., Cd-Zn & Cd-In, both show the segregating in nature at temperature 800 K for the concentration of range 0.1 to 0.9, however, Cd-Zn is more segregating than Cd-In.

scholarly journals Theoretical Investigation of Energetic and its Effect on Cd-Hg Amalgam

2016 ◽  
Vol 3 (1) ◽  
pp. 60
Author(s):  
I. Koirala ◽  
B.P. Singh ◽  
I.S. Jha ◽  
A.K. Mallik
Keyword(s):  
Short Range ◽  
Chemical Activity ◽  
Heat Of Mixing ◽  
Interaction Energies ◽  
Long Wavelength ◽  
Energy Of Mixing ◽  
Frame Work ◽  
Free Energy Of Mixing ◽  
Constituent Atom ◽  
Good Agreement

<p>The observed anomaly in properties of mixing of Cd-Hg alloys in the molten state is successfully explained on the basis of the quasi-lattice model. The thermodynamic functions such as free energy of mixing, heat of mixing, entropy of mixing and chemical activity of the constituent atom of the alloys and microscopic functions like concentration-concentration fluctuation in long wavelength limit and Warren-Cowley short range order parameter of the alloys have been computed within the frame work of presented model. Most of the computed values are in good agreement with the experimental data. The pair-wise interaction energies between the species of the melt are found to depend considerably on temperature. Theoretical analysis suggests that hetero-coordination leading to the formation of complex Cd<sub>2</sub>Hg is likely to exist but is of weakly interacting in nature.</p><p>Journal of Nepal Physical Society Vol.3(1) 2015: 60-66</p>

scholarly journals Thermodynamic, structural, transport and surface properties of Pb-Tl liquid alloy

BIBECHANA ◽  
2015 ◽  
Vol 13 ◽  
pp. 100-113 ◽  
Author(s):  
SK Yadav ◽  
LN Jha ◽  
D Adhikari
Keyword(s):  
Liquid Alloy ◽  
Surface Concentration ◽  
Heat Of Formation ◽  
Concentration Fluctuation ◽  
Heat Of Mixing ◽  
Long Wavelength ◽  
Wavelength Limit ◽  
Energy Of Mixing ◽  
Free Energy Of Mixing ◽  
Experimental Values

Thermodynamic properties, such as free energy of mixing, heat of mixing, entropy of mixing, activities and the microscopic structural properties, such as concentration fluctuation in long-wavelength limit and chemical short-range order parameter of Pb-Tl liquid alloy at 773 K have been studied on the basis of regular associated solution model. We have estimated the mole fractions of the complex and the unassociated atoms assuming the existence of  complex as energetically favoured in the liquid state. The compositional contributions of the heat of mixing of the species Pb and Tl and the heat of formation of the compound to the net enthalpy change have also been studied. The transport properties such as, viscosity and the ratio of mutual and intrinsic coefficients have been studied using different approaches. The surface concentration of Tl atoms has been computed and it has been employed to calculate the surface tension of Pb-Tl liquid alloy. Both the theoretical and the experimental values of the concentration fluctuation in long-wavelength limit are found to be less than the ideal value, revealing that the concerned system is hetero-coordinating in nature. The interaction energies are found to be temperature dependent and respective alloy is found to be weakly interacting system. BIBECHANA 13 (2016) 100-113

scholarly journals Energetics and local order in In-based liquid alloys

BIBECHANA ◽  
2015 ◽  
Vol 13 ◽  
pp. 60-71
Author(s):  
RP Koirala ◽  
BP Singh ◽  
IS Jha ◽  
D Adhikari
Keyword(s):  
Thermodynamic Properties ◽  
Local Order ◽  
Heat Of Mixing ◽  
Liquid Alloys ◽  
Association Model ◽  
Long Wavelength ◽  
Energy Of Mixing ◽  
Self Association ◽  
Free Energy Of Mixing ◽  
Solution Behaviour

A comparative study has been carried out to understand the concentration dependence of thermodynamic properties such as, free energy of mixing, heat of mixing, entropy of mixing, activity  and microscopic properties, such as concentration fluctuation in long wavelength limit  and Warren-Cowley short range order parameter  of  In-based three liquid alloys (In-Pb , In-Tl and In-Zn) on the basis of self-association model. The analysis reveals that self-association model successfully explains the observed properties of the liquid alloys.  Positive deviation of the thermodynamic properties of the alloys from the Raoultian solution behaviour indicates that the alloys are weakly segregating in nature. The comparative assessment of the interaction energy and the microscopic properties suggests that the degree of segregation is greatest in In-Zn alloy and comparable in In-Pb and In-Tl alloys.BIBECHANA 13 (2016) 60-71

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