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ChemRN: Theoretical Thermodynamics (Topic)

1,004 Total downloads

Viewing: 1 - 50 of 83 papers

1.

Introducing Black Oil Thermodynamics into the Lattice Boltzmann Method

Number of pages: 29 Posted: 07 May 2022
Working Paper Series
affiliation not provided to SSRN and The Pennsylvania State University
Downloads 48
2.

The Thermodynamics of Non-Equilibrium Interfaces During Phase Transformations in Concentrated Multicomponent Alloys

Number of pages: 29 Posted: 12 Aug 2022
Working Paper Series
Northwestern University - Department of Materials Science & Engineering, Université Paris-Dauphine, PSL Research University - MINES ParisTech, Université Paris-Dauphine, PSL Research University - MINES ParisTech and Northwestern University - Department of Materials Science & Engineering
Downloads 44
3.

Computational Modelling of the Local Structure and Thermophysical Properties of Ternary Mgcl2-Nacl-Kcl Salt for Thermal Energy Storage Applications

Number of pages: 21 Posted: 18 Mar 2022
Working Paper Series
Universidad Complutense de Madrid (UCM) - Chemical Engineering and Materials Department, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 43
4.

Entropy is the Sum of Heat Capacities

Number of pages: 5 Posted: 20 Nov 2017 Last Revised: 30 Jun 2018
Working Paper Series
Liepaja University - Institute of Science and Innovative Technologies
Downloads 43
5.

New Approach to the Compound Energy Formalism (Nacef)Part Ii. Thermodynamic Modelling of the Al–Nb System Supported by First-Principles Calculations

Number of pages: 13 Posted: 20 Jun 2022
Working Paper Series
University of Lorraine, University of Lorraine, affiliation not provided to SSRN, affiliation not provided to SSRN, Federal University of Itajuba, affiliation not provided to SSRN, affiliation not provided to SSRN, University of Lorraine and University of Lorraine
Downloads 38
6.

Experimental Investigation and Multi-Objective Optimization of Boiler-Recuperator Systems to Reach MILD Combustion Characteristics

Number of pages: 33 Posted: 01 Sep 2022
Working Paper Series
Shahid Beheshti University and Shahid Beheshti University
Downloads 36
7.

Critical Evaluation and Thermodynamic Modeling of the Li-Se and Na-Se Binary Systems Using Combined Calphad and First-Principles Calculations Method

Number of pages: 20 Posted: 03 Feb 2022
Working Paper Series
Yangzhou University, Yangzhou University, Yangzhou University, Fuzhou University, Fuzhou University, Northwestern Polytechnical University, affiliation not provided to SSRN and Seoul National University
Downloads 33
8.

Ultrasound-Assisted Synthesis of a Metal-Organic Nanocomplex for Photocatalytic Degradation of Remdesivir: Theoretical, Degradation Kinetic, and Thermodynamic Studies

Number of pages: 29 Posted: 02 May 2022
Working Paper Series
Shiraz University, affiliation not provided to SSRN, University of Sistan and Baluchestan, affiliation not provided to SSRN, affiliation not provided to SSRN and University of Maragheh
Downloads 33
9.

Lattice Dynamical and Thermodynamic Properties Study of Ceria Using Density Functional Theory and Hubbard Correction

Number of pages: 12 Posted: 05 May 2022
Working Paper Series
affiliation not provided to SSRN and Wachemo University
Downloads 32
10.

Thermodynamics and Stability Analysis of Tsallis Holographic Dark Energy (Thde) Models in F(R,T) Gravity

Number of pages: 17 Posted: 06 Jun 2022
Working Paper Series
COMSATS University Islamabad, COMSATS University Islamabad and COMSATS University Islamabad
Downloads 32
11.

Crystal Chemistry and Thermodynamic Modelling of the Al13(Fe,Tm)4 Solid Solutions (Tm = Co, Cr, Ni, Pt)

Number of pages: 49 Posted: 22 Feb 2022
Working Paper Series
affiliation not provided to SSRN, Polytechnique Montreal - Department of Chemical Engineering, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 29
12.

New Approach to the Compound Energy Formalism (NACEF) Part I. Thermodynamic Modeling Based on the Sublattice Model

Number of pages: 25 Posted: 24 Jun 2022
Working Paper Series
University of Lorraine, University of Lorraine, Federal University of Itajuba, University of Lorraine and University of Lorraine
Downloads 28
13.

Simple-Mix: An Updated MATLAB Code for Thermodynamics Modeling in a Gamma-Type Stirling Engine with a Working Fluid Mixture

Number of pages: 11 Posted: 30 Aug 2022
Working Paper Series
Semnan University and Semnan University
Downloads 25
14.

A Comparative Study of Cosmo-Based and Equation-of-State Approaches for the Prediction of Solvation Energies Based on the Compsol Databank

Number of pages: 23 Posted: 06 Apr 2022
Working Paper Series
affiliation not provided to SSRN, University of Lorraine - Laboratoire Réactions et Génie des Procédés, University of Lorraine - Laboratoire Réactions et Génie des Procédés and affiliation not provided to SSRN
Downloads 22
15.

First-Principles Study of in Doped in Wse2

Number of pages: 23 Posted: 26 May 2022
Working Paper Series
Tianjin University of Commerce, Tianjin University of Commerce and Tianjin University
Downloads 21
16.

The Low-Temperature Heat Capacity and Thermodynamic Properties of Greigite (Fe3s4)

Number of pages: 20 Posted: 23 Mar 2022
Working Paper Series
Brigham Young University, Brigham Young University, Arizona State University (ASU) - School of Molecular Sciences and Center for Materials of the Universe, affiliation not provided to SSRN, Arizona State University (ASU) - School of Molecular Sciences and Center for Materials of the Universe and Brigham Young University
Downloads 21
17.

Generation of Magmatism Under Active Continental Margins: A Thermodynamic Study of Subduction and Translithospheric Diapirs

Number of pages: 43 Posted: 10 May 2022
Working Paper Series
Universidad de Salamanca, affiliation not provided to SSRN, affiliation not provided to SSRN and Stellenbosch University
Downloads 20
18.

Thermodynamic Data & Properties of Polyoxometalate Na6V10O28

Number of pages: 17 Posted: 12 Sep 2022
Working Paper Series
Chongqing University, Chongqing University, Chongqing University, Chongqing University and Chongqing University
Downloads 16
19.

Molar Thermodynamic Functions of the Improved Scarf Ii Oscillator

Number of pages: 16 Posted: 28 Apr 2022
Working Paper Series
Modibbo Adama University of Technology
Downloads 15
20.

Role of Lifshitz Transition Stabilized Carbon Hexagon Structure from Biaxial Strain: A Case of Sodium Carbide with Superconducting Condition

Number of pages: 10 Posted: 01 Nov 2022
Working Paper Series
Chulalongkorn University, affiliation not provided to SSRN, Chulalongkorn University, Chulalongkorn University, affiliation not provided to SSRN, Chiang Mai University, Chulalongkorn University and Uppsala University
Downloads 15
21.

Celecoxib Solubility in Two Choline Chloride-Based Deep Eutectic Solvents- Experimental Study, Thermodynamic Modeling, and Molecular Dynamic Simulation

Number of pages: 29 Posted: 11 Oct 2022
Working Paper Series
Tarbiat Modares University, Tarbiat Modares University and Hamedan University of Technology
Downloads 14
22.

Eco-Friendly Adsorption/Biosorption of Uranium from Aqueous Solutions Using Scx-37 Composite Adsorbent/Biosorbent

Number of pages: 20 Posted: 26 Feb 2022
Working Paper Series
affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 13
23.

Highly Differentiated Trachytic Magma Linked with Rare Metal Mineralization: A Case Study from the Shuanghekou Nb Deposit, South Qinling

Number of pages: 42 Posted: 15 Aug 2022
Working Paper Series
Chinese Academy of Geological Sciences, Chinese Academy of Geological Sciences, Chinese Academy of Geological Sciences, Chinese Academy of Geological Sciences, Chinese Academy of Geological Sciences, China Geological Survey (CGS) and China Geological Survey (CGS)
Downloads 13
24.

Modeling the Phase Evolution in Alkali-Activated Slag Cements Upon Interaction with Seawater

Number of pages: 17 Posted: 04 May 2022
Working Paper Series
Pukyong National University, Korea Institute of Geoscience and Mineral Resources and Pukyong National University
Downloads 13
25.

Thermodynamic Analysis of a Two-Stage Binary-Fluid Ejector Heat Pump Water Heater

Number of pages: 30 Posted: 06 Jul 2022
Working Paper Series
Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, affiliation not provided to SSRN, Government of the United States of America - Oak Ridge National Laboratory, affiliation not provided to SSRN and Government of the United States of America - Oak Ridge National Laboratory
Downloads 13
26.

Adiabatic Self-Heating Determination for Ti6al4v at Different Temperatures

Number of pages: 22 Posted: 15 Apr 2022
Working Paper Series
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 12
27.

Experimental Investigation on the Phases Transitions in O-Rich Side of the Zr-O System

Number of pages: 16 Posted: 14 Jun 2022
Working Paper Series
University of Paris-Saclay - Service de la Corrosion et du Comportement des Matériaux dans leur Environnement (SCCME), University of Paris-Saclay - Service de la Corrosion et du Comportement des Matériaux dans leur Environnement (SCCME), University of Paris-Saclay - Service de la Corrosion et du Comportement des Matériaux dans leur Environnement (SCCME), University of Paris-Saclay - Service de la Corrosion et du Comportement des Matériaux dans leur Environnement (SCCME), University of Paris-Saclay - Service de Recherches Métallurgiques Appliquées and Sorbonne-Université
Downloads 12
28.

Precipitation of Methionine and Ethyl Cellulose in Carbon Dioxide + Ethanol + Acetic Acid Systems at High Pressures: Phase Equilibrium Data for the GAS Antisolvent Process

Number of pages: 35 Posted: 09 Sep 2022
Working Paper Series
Universidade Federal de Santa Catarina (UFSC), Universidade Federal de Santa Catarina (UFSC), Universidade Federal de Santa Catarina (UFSC), Universidade Federal de Santa Catarina (UFSC) and Universidade Federal de Santa Catarina (UFSC)
Downloads 11
29.

Reactive Extraction of Gallic Acid Using Tri-N-Octylamine in a Biocompatible Mixture of Modifier and Inert Solvent: Equilibria and Thermodynamics

Number of pages: 17 Posted: 23 Apr 2022
Working Paper Series
affiliation not provided to SSRN, Motilal Nehru National Institute of Technology Allahabad - Department of Chemical Engineering and National Institute of Technology Raipur
Downloads 11
30.

Thermodynamic Modelling of Mdea(Aq)-Nh3(Aq)-K2co3(Aq)-Co2(Aq) Using the Extended Uniquac Model

Number of pages: 54 Posted: 11 Aug 2022
Working Paper Series
Technical University of Denmark, Technical University of Denmark and Technical University of Denmark
Downloads 11
31.

A Predictive Procedure to Model Gas Transport and Intrinsic Properties of Rubbery Polymeric Membranes Using Equilibrium Thermodynamics and Free Volume Theory

Number of pages: 35 Posted: 17 May 2022
Working Paper Series
affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 10
32.

Analysis of Experimental Heats of Dilution of Aqueous Solutions of Nabph by Use of the Mean Spherical Approximation and Molecular Dynamics Simulations

Science Direct Working Paper No S1574-0331(04)70230-1
Number of pages: 31 Posted: 23 May 2017 Last Revised: 09 Dec 2017
Working Paper Series
Laboratoire d’Electrochimie des Solutions - Faculté des Sciences, Laboratoire d’Electrochimie des Solutions - Faculté des Sciences and Université Louis Pasteur - Laboratoire MSM
Downloads 10
33.

Investigation of the Solid/Liquid Phase Transitions in the U–Pu–O System

Number of pages: 32 Posted: 19 Sep 2022
Working Paper Series
affiliation not provided to SSRN, affiliation not provided to SSRN, European Union - European Commission, Karlsruhe Institute of Technology, Karlsruhe Institute of Technology, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 10
34.

Research of a Thermodynamic Function[[Equation]]: Temperature Dependence and Relation to Properties at Infinite Dilution

Number of pages: 19 Posted: 13 May 2022
Working Paper Series
Ocean University of China, affiliation not provided to SSRN, Ocean University of China, Ocean University of China, Ocean University of China - Key Laboratory of Marine Chemistry Theory and Technology, Ocean University of China and Ocean University of China
Downloads 10
35.

The Extraction of Aromatics Using Nmp: Liquid-Liquid Equilibrium Determination and Mechanistic Exploration

Number of pages: 21 Posted: 22 Aug 2022
Working Paper Series
Qingdao University of Science and Technology, Qingdao University of Science and Technology, Qingdao University of Science and Technology, Qingdao University of Science and Technology, Qilu Normal University and Qingdao University of Science and Technology
Downloads 10
36.

Thermodynamic Perturbation Theory Coefficients for Hard Spherocylinders and Cylinders

Number of pages: 43 Posted: 20 May 2022
Working Paper Series
affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 10
37.

Effect of Cu Thickness on the Interfacial Reactions and Connection Strength of Laser Welded-Brazed Mg/Steel Joint

Number of pages: 44 Posted: 29 Jul 2022
Working Paper Series
Lancaster University, affiliation not provided to SSRN, affiliation not provided to SSRN, Harbin Institute of Technology and Lancaster University - Department of Engineering
Downloads 9
38.

Kinetic and Thermodynamic Modeling of Ethyl Transesterification of Degummed Soybean Oil Catalyzed by Zr/Cao

Number of pages: 37 Posted: 15 Jun 2022
Working Paper Series
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 9
39.

Speciation Calculation and Molalities Determination by Using Electrical Conductivity Measurements and Multi-Objective Optimization Approach: Application to the SO4-H2O Thermodynamic System at Various Temperatures from 288.65 K to 366.45 K

Number of pages: 14 Posted: 09 Sep 2022
Working Paper Series
Mohammed VI Polytechnic University, Mohammed VI Polytechnic University, Mohammed VI Polytechnic University and Mohammed VI Polytechnic University
Downloads 9
40.

Study on the Solid-Liquid Equilibrium of Triphenylphosphine in Four Mono-Solvents and Two Mixed Solvents

Number of pages: 24 Posted: 30 Mar 2022
Working Paper Series
Zhengzhou University, affiliation not provided to SSRN, Zhengzhou University and Zhengzhou University
Downloads 9
41.

Synthesis and Study of Microcapsules with Beeswax Core and Phenol-Formaldehyde Shell by Taguchi Method

https://sciforum.net/paper/view/11207
Number of pages: 5 Posted: 10 Nov 2021
Accepted Paper Series
Department of Polymer and Surface Engineering, Institute of Chemical Technology, Mumbai and affiliation not provided to SSRN
Downloads 9
42.

Thermal Stability of Ionic Solids:A Melting Points Survey

Number of pages: 13 Posted: 05 Sep 2022
Working Paper Series
Curtin University
Downloads 9
43.

Thermodynamic Modeling of Determined the Optimal Condition of the Gas Antisolvent Process with Different Solvent

Number of pages: 44 Posted: 16 Sep 2022
Working Paper Series
University of Kashan, Islamic Azad University (IAU) - Marvdasht Branch, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 9
44.

Cu- and Pt- Based Bulk Metallic Glasses: A Thermodynamical Approach

Number of pages: 5 Posted: 06 Jun 2022
Working Paper Series
affiliation not provided to SSRN
Downloads 8
45.

Enhancing Elastocaloric Strength by Combining Positive and Negative Elastocaloric Effects

Number of pages: 14 Posted: 02 May 2022
Working Paper Series
Beijing Institute of Technology, Beijing Institute of Technology - Advanced Research Institute of Multidisciplinary Science, Beijing Institute of Technology, Beijing Institute of Technology, Huazhong University of Science and Technology, Guilin University of Electronic Technology and Beijing Institute of Technology - Advanced Research Institute of Multidisciplinary Science
Downloads 8
46.

Searching for Suitable Binary Fluid for an Ejector-Assisted Heat Pump for Domestic Water Heating

Number of pages: 26 Posted: 30 Jul 2022
Working Paper Series
Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, affiliation not provided to SSRN, affiliation not provided to SSRN, Government of the United States of America - Oak Ridge National Laboratory, affiliation not provided to SSRN, affiliation not provided to SSRN and Government of the United States of America - Oak Ridge National Laboratory
Downloads 8
47.

Ternary (Liquid + Liquid) Equilibrium Experiment and Thermodynamic Modeling of Water + O-Cresol + Solvents (Mesityl Oxide or N-Propyl Acetate) at 303.2, 313.2, and 323.2 K Under 101.3 Kpa

Number of pages: 24 Posted: 23 Mar 2022
Working Paper Series
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 8
48.

Thermodynamic and Dynamic Simulations of Chloride Ion Physisorption on C-S-H Gel Surface

Number of pages: 38 Posted: 29 Mar 2022
Working Paper Series
Southeast University, Southeast University and Southeast University
Downloads 8
49.

Entropy Bound of D -Dimensional Reissner-Nordstro¨M Black Hole in Rainbow Gravity

Number of pages: 18 Posted: 07 May 2022
Working Paper Series
affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 7
50.

Evolutionary Optimization Strategies for Liquid-Liquid Interaction Parameters

Number of pages: 17 Posted: 08 Apr 2022
Working Paper Series
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 7