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<xml><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>General Sciences</ArticleType><ArticleTitle>Structural and Electrical Studies on PVP - Pan Blend Polymer System for Energy Storage Devices&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>19</FirstPage><LastPage>24</LastPage><AuthorList><Author>R. Daniel</Author><AuthorLanguage>English</AuthorLanguage><Author> S. Janet Priscilla</Author><AuthorLanguage>English</AuthorLanguage><Author> S. Karthikeyan</Author><AuthorLanguage>English</AuthorLanguage><Author> S. Selvasekarapandian</Author><AuthorLanguage>English</AuthorLanguage><Author> S. Madeswaran</Author><AuthorLanguage>English</AuthorLanguage><Author> K. Sivaji</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>Research on Polymeric materials have special interest in the recent years due to its high stability and hazardous free nature that are useful for the development of sensors, photovoltaic cells, high energy electrochemical devices, fuel cell etc. Solid blend polymer films have been prepared with the polymers polyvinylpyrrolidone (PVP) &amp; polyacrylonitrile (PAN) by solution casting technique. The prepared films were investigated by different techniques. The XRD results confirms that the variation in the amorphous nature of the blend polymer with different blend-ratio. AC impedance spectroscopy has been used to examine the ionic conductivity and dielectric behavior of all the prepared blend polymer films was investigated in the frequency range 20 Hz to 4 MHz. The maximum conductivity has been found to be 4.45 &#xD7; 10&#x2212; 8 S cm&#x2212; 1 at room temperature. The conductivity has been increased to 1.68 &#xD7; 10&#x2212;5 S cm&#x2212;1 as the temperature is increased to 373 K. The activation energy of all the concentration of blend polymer was calculated using the Arrhenius plot and it is found to be 0.91 eV to 1.41 eV.&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>Blend Polymer, PVP, PAN, Impedance spectroscopy analysis</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2556</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2556</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>General Sciences</ArticleType><ArticleTitle>Effect of Concentration, pH and Time on the Morphology of Silver Nanoparticles Synthesized by Green Method using Phyllanthus Niruri and Solanum Nigrum Leaf Extracts&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>25</FirstPage><LastPage>29</LastPage><AuthorList><Author>M. Sundarrajan</Author><AuthorLanguage>English</AuthorLanguage><Author> A. Jeelani</Author><AuthorLanguage>English</AuthorLanguage><Author> V. Santhanam</Author><AuthorLanguage>English</AuthorLanguage><Author> S. Durgadevi</Author><AuthorLanguage>English</AuthorLanguage><Author> S. Abirami</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>Nanoparticles find many applications due to their small size and hence enhanced physical and chemical properties. Various physical, chemical and biological methods are available for nanosynthesis and they bring some contamination to the product and hence to the environment. In order to eliminate the contamination to the environment green methods are employed for nano synthesis. The green synthesis of nanoparticles are achieved by using plant products such as leaves, roots, flowers and fruits with the precursor solution. In this work, extracts from Phyllanthus Niruri and Solanum Nigrum leaves were utilized for the synthesis of silver nanoparticles (AgNps) from silver nitrate solution. Bio active molecules present in the extract act as reducing and capping agents in the green synthesis. The bioactive components of extracts and the morphology of AgNps were studied FTIR, ultraviolet-visible spectroscopy(UV-Vis), FTIR, SEM and Dynamic Light Scattering analysis (DLS).&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>Green Synthesis, Silver Nanoparticles, Phyllanthus Niruri and Solanum Nigrum leaves, UV-Vis Spectroscopy, FTIR, SEM, and Dynamic Light Scattering (DLS) analysis</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2557</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2557</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2019</Year><Month>February</Month><Day>20</Day></PubDate></Journal><ArticleType>Healthcare</ArticleType><ArticleTitle>Quick and Accurate Determination of Presbyopic Addition&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>14</FirstPage><LastPage>18</LastPage><AuthorList><Author>Rupesh Sah</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>Background: Presbyopia is one of the common condition where the near point recede beyond the distance at which the individual is accustomed to read or to work, being unable to see clearly. It is the gradual loss of the eyes ability to focus on nearby objects. The use of plus lenses to compensate for the reduction in the range of accommodation associated with presbyopia, brings the near point of accommodation to a comfortable distance for near visual task. This study is done to estimate an ideal clinical methods of measuring near addition for presbyopic patients. Material and Methods: Sixty healthy subjects with a mean age of 50 years were participatedin this study. Tentative near additions were determined usingnegative and positive relative accommodation (NRA &amp; PRA), fused cross-cylinder (JCC) and Near Duochrome. The power of the addition was then refined to arrive at the final addition. Result: There is no statistical significant difference between near duochrome and final addition power (0.03 &#xB1; 0.50) with p-value 0.584554 whereas there is statistical significant difference between NRA PRA (0.13 &#xB1; 0.55) with p-value 0.04105 and JCC (0.33 &#xB1; 0.46) with p-value </Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>Refractive error, Accommodation, Presbyopia, Near addition, NRA PRA, Near duochrome, Jackson Cross Cylinder</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2570</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2570</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>General Sciences</ArticleType><ArticleTitle>Study of Structural and Morphological Properties of Vacuum Coated Copper Oxide (Cuo) Thin Film by Thermal Evaporation Technique&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>91</FirstPage><LastPage>93</LastPage><AuthorList><Author>Suganthi J.</Author><AuthorLanguage>English</AuthorLanguage><Author> Priyanka Jain</Author><AuthorLanguage>English</AuthorLanguage><Author> Johnsonjeyakumar S.</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>In this present study Copper and Copper oxide thin film deposited on a glass substrate by vacuum coater. Thermal evaporation deals with the evaporation of the source materials in a vacuum chamber and condensing the evaporated particles on a substrate. This process is conventionally called vacuum deposition. The structural, morphological studies of Copper (Cu) and copper oxide (CuO) thin films prepared by thermal evaporation method have been studied. Structural analysis results of Cu thin films demonstrate that the single phase of Cu with high a crystalline structure with a preferred orientation (111). X-ray diffraction results confirm the formation of pure (CuO) phase in thermal evaporation method. The SEM images of CuO thin films shows morphology of CuO thin films prepared at 100&#xB0;C. The images show that the grains are not highly homogeneous in shape and size there is shape cubic, spherical and others.&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>Copper Oxide, Morphology, Structural properties, Thin Films, Thermal Evaporation etc.</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2571</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2571</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>Healthcare</ArticleType><ArticleTitle>A Study on the Acoustic and Rheological Properties of Polystyrene in Different Solvents&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>99</FirstPage><LastPage>102</LastPage><AuthorList><Author>Padmanaban R.</Author><AuthorLanguage>English</AuthorLanguage><Author> Venkatramanan K.</Author><AuthorLanguage>English</AuthorLanguage><Author> Arumugam R.</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>Polystyrene (PS) is a synthetic aromatic hydrocarbon polymer prepared from the monomer styrene. Polystyrene can be foamed or solid. General-purpose polystyrene is hard, clear and rather brittle. It is a low cast resin per unit weight. It is a rather poor barrier to oxygen and water vapour and has a relatively low melting point. Polystyrene is one of the most widely used plastics, the scale of its production being several million tonnes per year. Polystyrene can be naturally transparent, but can be coloured with colourants. Uses include protective packaging (such as packing peanuts and DVD and CD cases), bottles, trays, containers, lids, tumblers, disposable cutlery and in the making of models. In the present study an attempt has been made to compute the viscosity of Polystyrene (M.W: 35000) in toluene and 1,4-Dioxane at different concentrations (0.2%, 0.4%, 0.6%, 0.8% &amp; 1.0%) at different temperatures (303 K, 308 K, 313 K &amp; 318 K). From these experimental data, activation energy is calculated and the effect of solvent is analyzed. Density and ultrasonic velocity have been estimated for the above systems at 303K. From these experimental values, various molecular interaction parameters like free volume, internal pressure, viscous relaxation time, inter-atomic free length, etc. are calculated and discussed in terms of solute-solvent interactions.&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>Activation energy, Free volume, Internal Pressure, Ultrasonic velocity</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2572</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2572</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>Healthcare</ArticleType><ArticleTitle>Linear Optical Studies of Nonlinear Optical Glycine - Phthalic Acid Single Crystal&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>103</FirstPage><LastPage>105</LastPage><AuthorList><Author>M. Suresh Kumar</Author><AuthorLanguage>English</AuthorLanguage><Author> G.V. Vijayaraghavan</Author><AuthorLanguage>English</AuthorLanguage><Author> S. Krishnan</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>Good quality Glycine-Phthalic acid single crystals were grown by slow evaporation solution growth technique. Glycine and Phthalic acid materials were taken in the ratio of 1:1 for solution preparation with water as a solvent. Single crystal X-Ray diffraction of Glycine-Phthalic acid crystal was analysed to find lattice parameters, space group and crystal system. The study proves Glycine-Phthalic acid is orthorhombic crystal system and space group is Pbca. UV- Vis Transmission study was carried out on Glycine-Phthalic acid sample crystal. The lower cut-off wave length of the material is 234 nm. The optical band gap was determined as 4.979 eV. Extinction coefficient, Reflectance and&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>X-Ray diffraction, Optical Band Gap, Refractive index</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2573</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2573</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>Healthcare</ArticleType><ArticleTitle>Molecular Docking, Quantum Chemical Analyses of Molecular Structure and Spectroscopic Investigations of N-[1-(1-Benzothien-2-yl)ethyl]-N-hydroxyurea: A Combined Experimental and Theoretical Studies&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>106</FirstPage><LastPage>111</LastPage><AuthorList><Author>C. Charanya</Author><AuthorLanguage>English</AuthorLanguage><Author> S. Sampathkrishnan</Author><AuthorLanguage>English</AuthorLanguage><Author> A. Bhaskaran</Author><AuthorLanguage>English</AuthorLanguage><Author> N. Balamurugan</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>The structure of N-[1-(1-benzothien-2-yl)ethyl]-N-hydroxyurea (C11H12N2O2S, Zileuton) was investigated on the basis of spectroscopic data and theoretical calculations. The optimized geometry, intensity and frequency of the vibrational bands of the compound was obtained by Density Functional Theory(DFT) using B3LYP/6-31+G(d,p) basis set. The FT-IR and FT-Raman spectra of the Zileuton were recorded in the range of 4000&#x2013;400 cm&#x2212;1 and 4000&#x2013;400 cm&#x2212;1, respectively. The harmonic vibrational frequencies were calculated and scaled values have been compared with experimental FT-IR and FT-Raman spectra. The observed and calculated frequencies are found to be in good agreement. A detailed interpretation of the FT-IR and FT-Raman spectra were also reported based on Potential Energy Distribution (PED). To confirm the potential of Zileuton molecule in the area of pharmaceutics, we have also calculated a series of drug likeness parameters. Possibly important biological activity of Zileuton molecule was also confirmed by molecular docking study.&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>Zileuton, DFT, FT-IR, FT-Raman, Molecular docking</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2574</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2574</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>Healthcare</ArticleType><ArticleTitle>Air Pollution Monitoring System using Android Application&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>112</FirstPage><LastPage>115</LastPage><AuthorList><Author>Kurubaran A.</Author><AuthorLanguage>English</AuthorLanguage><Author> Varun Krishna S.</Author><AuthorLanguage>English</AuthorLanguage><Author> Vignesh K.</Author><AuthorLanguage>English</AuthorLanguage><Author> Bhaskaran A.</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>Air Pollution is causing a severe threat to the environment. In order to the survival of the environment and humans, a new system is designed to reduce the pollution. In this system, two sensors MQ7 and MQ135 are used.MQ7 sensor is used to detect the level of Carbon Monoxide in the atmosphere. MQ135 sensor is used to detect the quality of air in the atmosphere. These sensors will detect the level of pollution in the environment. After detecting the level of pollution in the environment, it is made available for the people to view the pollution level using an android application. Android application is designed in such a way such that it is provided with user name and password. The android application is also made to be connected with Global Positioning System. In the android application, if the location is specified, the person can view the level of pollution. So, further actions can be taken for reducing pollution by informing to respective authorities. The user can use this android application anywhere and he can view the level of pollution.&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>MQ7,MQ135 Sensor , Internet of Things, Android application</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2575</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2575</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>Healthcare</ArticleType><ArticleTitle>Effect of Dimethyl Carbonate on Performance and Emission Characteristics of a Diesel Engine&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>116</FirstPage><LastPage>121</LastPage><AuthorList><Author>Sharan P.</Author><AuthorLanguage>English</AuthorLanguage><Author> Bhaskaran A.</Author><AuthorLanguage>English</AuthorLanguage><Author> Kalpana S.</Author><AuthorLanguage>English</AuthorLanguage><Author> Ramesh Babu A.</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>The exhaust from vehicles pollutes the environment and contributes to global warming, acid rain, SMOG, respiratory and other health problems. In this work, Dimethyl Carbonate (DMC) is mixed as an additive to the diesel as pilot fuel, with focus on reduction of harmful exhaust emissions and maintaining high Brake Thermal Efficiency. The performance and emission characteristics of the diesel engine operated with diesel fuel mixed with DMC (5%) was studied. These results were compared with the neat diesel as base fuel. The experimental study found that diesel engines fueled with DMC had improved the combustion and emission performances without significant increase in NOx emissions. By using biodiesel, there are some disadvantages such as higher density, lesser heating value, high fuel consumption and high oxides of nitrogen. To avoid above disadvantages, the fuel additives help in playing a very important role in minimizing the drawbacks of biodiesel and in maintaining international fuel standards. Additives can be considered toward to improve combustion, fuel economy and to decrease the emissions. In particular, DMC may be a promising additive for diesel fuel owing to its high oxygen content, no carbon-carbon atomic bonds, suitable boiling points and solubility in diesel fuel.&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>Global warming, DMC, NOx, Biodiesel</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2576</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2576</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>Healthcare</ArticleType><ArticleTitle>Adsorption Studies on Reactive Black 5 by Varying the Composition of Sorel Cement&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>122</FirstPage><LastPage>125</LastPage><AuthorList><Author>A. Bhaskaran</Author><AuthorLanguage>English</AuthorLanguage><Author> R. Hariharasuthan</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>Search for new, cheaper and effective adsorbents especially for textile and leather dye effluents are in constant progress. Batch experiments were carried out for the adsorption of Reactive Black 5 by varying the composition of Sorel Cement. The composition of MgO and MgCl2 are varied. Further the Sorel cement was doped with FeCl3 and its adsorption capacity investigated. The effect of initial dye concentration, pH, and temperature and contact time were studied. The equilibrium data were fitted into Freundlich and Langmuir adsorption isotherms. The adsorption efficiency and adsorption capacity factor were calculated. The composition doped with FeCl3 showed a higher adsorption capacity. Such composites can be used to remove other organic dyes also. The process is chemisorption which increased with temperature and so the rate and extent of adsorption increased. Kinetics studies were fitted into pseudo first order rate expression.&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>Higher adsorption capacity, Thermodynamic parameters, Sorel cement</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2577</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2577</Fulltext></URLs></Article></ArticleSet><ArticleSet><Article><Journal><PublisherName>Radiance Research Academy</PublisherName><JournalTitle>International Journal of Current Research and Review</JournalTitle><PISSN>2231-2196</PISSN><EISSN>0975-5241</EISSN><Volume>Vol 10 issue 21 special issue</Volume><Issue/><IssueLanguage>English</IssueLanguage><SpecialIssue>N</SpecialIssue><PubDate><Year>2018</Year><Month>November</Month><Day>14</Day></PubDate></Journal><ArticleType>General Sciences</ArticleType><ArticleTitle>Vibrational and Spectroscopic Analysis on 2,3-Dimercapto-1- Propanol by HF and DFT Calculations&#xD;
</ArticleTitle><ArticleLanguage>English</ArticleLanguage><FirstPage>94</FirstPage><LastPage>98</LastPage><AuthorList><Author>K. Rajalakshmi</Author><AuthorLanguage>English</AuthorLanguage><Author> G. Kalaiarasi</Author><AuthorLanguage>English</AuthorLanguage></AuthorList><Abstract>A combined experimental and theoretical study on molecular and vibrational structure of 2,3-Dimercapto-1-propanol have been undertaken in the present work. The FTIR Spectrum and FT-Raman spectrum of the molecule have been recorded in the region of 4000-400 cm-1 and 4000-100 cm-1. The optimized geometry, frequency and intensity of the vibrational bands of the molecule were obtained at HF and DFT (B3LYP) levels using 6-31G (d,p) basis set. A Complete vibrational assignments for the theoretical harmonic frequency were made and compared with the experimental frequencies recorded. HOMO-LUMO study confirms the charge transfer within the molecule. Mulliken population analysis and thermodynamic properties of the molecule were tabulated.&#xD;
</Abstract><AbstractLanguage>English</AbstractLanguage><Keywords>2, 3-Dimercapto-1-propanol, FT-IR, FT- Raman, DFT</Keywords><URLs><Abstract>http://ijcrr.com/abstract.php?article_id=2578</Abstract><Fulltext>http://ijcrr.com/article_html.php?did=2578</Fulltext></URLs></Article></ArticleSet></xml>
