Download or read book Vapor liquid Equilibrium Data Collection Aqueous organic systems written by Jürgen Gmehling and published by . This book was released on 2004 with total page 570 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Dechema Chemistry Data Series written by and published by . This book was released on 1977 with total page 672 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Vapor liquid Equilibrium Data Collection written by Jürgen Gmehling and published by . This book was released on 1977 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Practical Data Analysis in Chemistry written by Marcel Maeder and published by Elsevier. This book was released on 2007-08-10 with total page 341 pages. Available in PDF, EPUB and Kindle. Book excerpt: The majority of modern instruments are computerised and provide incredible amounts of data. Methods that take advantage of the flood of data are now available; importantly they do not emulate 'graph paper analyses' on the computer. Modern computational methods are able to give us insights into data, but analysis or data fitting in chemistry requires the quantitative understanding of chemical processes. The results of this analysis allows the modelling and prediction of processes under new conditions, therefore saving on extensive experimentation. Practical Data Analysis in Chemistry exemplifies every aspect of theory applicable to data analysis using a short program in a Matlab or Excel spreadsheet, enabling the reader to study the programs, play with them and observe what happens. Suitable data are generated for each example in short routines, this ensuring a clear understanding of the data structure. Chapter 2 includes a brief introduction to matrix algebra and its implementation in Matlab and Excel while Chapter 3 covers the theory required for the modelling of chemical processes. This is followed by an introduction to linear and non-linear least-squares fitting, each demonstrated with typical applications. Finally Chapter 5 comprises a collection of several methods for model-free data analyses.* Includes a solid introduction to the simulation of equilibrium processes and the simulation of complex kinetic processes.* Provides examples of routines that are easily adapted to the processes investigated by the reader* 'Model-based' analysis (linear and non-linear regression) and 'model-free' analysis are covered
Download or read book Machine Learning in Chemistry written by Edward O. Pyzer-Knapp and published by . This book was released on 2020-10-22 with total page 140 pages. Available in PDF, EPUB and Kindle. Book excerpt: Atomic-scale representation and statistical learning of tensorial properties -- Prediction of Mohs hardness with machine learning methods using compositional features -- High-dimensional neural network potentials for atomistic simulations -- Data-driven learning systems for chemical reaction prediction: an analysis of recent approaches -- Using machine learning to inform decisions in drug discovery : an industry perspective -- Cognitive materials discovery and onset of the 5th discovery paradigm.
Download or read book Thermodynamics written by Jean Vidal and published by Editions OPHRYS. This book was released on 1980 with total page 522 pages. Available in PDF, EPUB and Kindle. Book excerpt: The simulation and optimization of processes assumes that the thermodynamic properties and phase equilibria of the mixtures concerned are well known. This knowledge is still based upon experimentation, but it is also the result of calculation methods based on the principles of thermodynamics that govern them, insure their coherence, and confer upon them a wide range of application. This text is concerned primarily with the description of these methods and their evolution. It devotes extensive space to fundamental concepts and places particular emphasis on the models that, although based on simplified concepts of the subject matter at the molecular level, have predictive character. Computational examples are used to explain the application of these concepts and models. Contents: 1. Principles. Thermodynamic functions. The ideal gas. 2. Properties of pure substances. 3. Predicting thermodynamic properties of pure substances. General principles. Corresponding states. Group contributions. 4. Equations of state. 5. Characterization of mixtures. 6. Mixtures: liquid-vapor equilibria. 7. Deviations from ideality in the liquid phase. 8. Application of equations of state to mixtures. Calculation of liquid-vapor equilibria under pressure. 9. Liquid-liquid and liquid-liquid-vapor equilibria. 10. Fluid-solid equilibria. Crystallization. Hydrates. 11. Polymer solutions and alloys. 12. Multicomponent mixtures. 13. Chemical reactions. Appendixes. Index. Bibliography.
Download or read book Tables of Spectral Data for Structure Determination of Organic Compounds written by Ernö Pretsch and published by Springer Science & Business Media. This book was released on 2013-06-29 with total page 325 pages. Available in PDF, EPUB and Kindle. Book excerpt: Although numerical data are, in principle, universal, the compilations presented in this book are extensively annotated and interleaved with text. This translation of the second German edition has been prepared to facilitate the use of this work, with all its valuable detail, by the large community of English-speaking scientists. Translation has also provided an opportunity to correct and revise the text, and to update the nomenclature. Fortunately, spectroscopic data and their relationship with structure do not change much with time so one can predict that this book will, for a long period of time, continue to be very useful to organic chemists involved in the identification of organic compounds or the elucidation of their structure. Klaus Biemann Cambridge, MA, April 1983 Preface to the First German Edition Making use of the information provided by various spectroscopic tech niques has become a matter of routine for the analytically oriented organic chemist. Those who have graduated recently received extensive training in these techniques as part of the curriculum while their older colleagues learned to use these methods by necessity. One can, therefore, assume that chemists are well versed in the proper choice of the methods suitable for the solution of a particular problem and to translate the experimental data into structural information.
Download or read book Data Science in Chemistry written by Thorsten Gressling and published by Walter de Gruyter GmbH & Co KG. This book was released on 2020-11-23 with total page 540 pages. Available in PDF, EPUB and Kindle. Book excerpt: The ever-growing wealth of information has led to the emergence of a fourth paradigm of science. This new field of activity – data science – includes computer science, mathematics and a given specialist domain. This book focuses on chemistry, explaining how to use data science for deep insights and take chemical research and engineering to the next level. It covers modern aspects like Big Data, Artificial Intelligence and Quantum computing.
Download or read book Liquid liquid Equilibrium Data Collection Ternary systems written by Jens M. Sørensen and published by Dechema. This book was released on 1980 with total page 682 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Data Analysis for Omic Sciences Methods and Applications written by and published by Elsevier. This book was released on 2018-09-22 with total page 732 pages. Available in PDF, EPUB and Kindle. Book excerpt: Data Analysis for Omic Sciences: Methods and Applications, Volume 82, shows how these types of challenging datasets can be analyzed. Examples of applications in real environmental, clinical and food analysis cases help readers disseminate these approaches. Chapters of note include an Introduction to Data Analysis Relevance in the Omics Era, Omics Experimental Design and Data Acquisition, Microarrays Data, Analysis of High-Throughput RNA Sequencing Data, Analysis of High-Throughput DNA Bisulfite Sequencing Data, Data Quality Assessment in Untargeted LC-MS Metabolomic, Data Normalization and Scaling, Metabolomics Data Preprocessing, and more. - Presents the best reference book for omics data analysis - Provides a review of the latest trends in transcriptomics and metabolomics data analysis tools - Includes examples of applications in research fields, such as environmental, biomedical and food analysis
Download or read book CRC Handbook of Chemistry and Physics written by William M. Haynes and published by CRC Press. This book was released on 2016-04-19 with total page 2633 pages. Available in PDF, EPUB and Kindle. Book excerpt: Mirroring the growth and direction of science for a century, the Handbook, now in its 93rd edition, continues to be the most accessed and respected scientific reference in the world. An authoritative resource consisting tables of data, its usefulness spans every discipline. This edition includes 17 new tables in the Analytical Chemistry section, a major update of the CODATA Recommended Values of the Fundamental Physical Constants and updates to many other tables. The book puts physical formulas and mathematical tables used in labs every day within easy reach. The 93rd edition is the first edition to be available as an eBook.
Download or read book The Crystalline States of Organic Compounds written by Angelo Gavezzotti and published by Elsevier. This book was released on 2021-11-25 with total page 304 pages. Available in PDF, EPUB and Kindle. Book excerpt: The Crystalline States of Organic Compounds is a broad survey of the techniques by which molecular crystals are investigated, modeled, and applied, starting with the fundamentals of intra- and intermolecular bonding supplemented by a concise tutorial on present-day diffraction methods, then proceeding to an examination of crystallographic databases with their statistics and of such fundamental and fast-growing topics as intermolecular potentials, polymorphism, co-crystallization, and crystal structure prediction by computer. A substantial part of the book is devoted to the techniques of choice in modern simulation, Monte Carlo and molecular dynamics, with their most recent developments and application to formed crystals and to the concomitant phases involved in nucleation and growth. Drawing on the decades-long experience of its author in teaching and research in the field of organic solid state, The Crystalline States of Organic Compounds is an indispensable source of key insights and future directions for students and researchers at any level, in academia and in industry. - Condenses theoretical information and practical methods in a single resource - Provides a guide on the use of crystallographic databases, structure statistics, and molecular simulations - Includes a large number of worked examples and tutorials, with extensive graphics and multimedia
Download or read book Annual Reports in Computational Chemistry written by and published by Elsevier. This book was released on 2015-11-29 with total page 438 pages. Available in PDF, EPUB and Kindle. Book excerpt: Annual Reports in Computational Chemistry provides timely and critical reviews of important topics in computational chemistry as applied to all chemical disciplines. Topics covered include quantum chemistry, molecular mechanics, force fields, chemical education, and applications in academic and industrial settings. Focusing on the most recent literature and advances in the field, each article covers a specific topic of importance to computational chemists. - Quantum chemistry - Molecular mechanics - Force fields - Chemical education and applications in academic and industrial settings
Download or read book CRC Handbook of Chemistry and Physics 96th Edition written by William M. Haynes and published by CRC Press. This book was released on 2015-06-09 with total page 2652 pages. Available in PDF, EPUB and Kindle. Book excerpt: Proudly serving the scientific community for over a century, this 96th edition of the CRC Handbook of Chemistry and Physics is an update of a classic reference, mirroring the growth and direction of science. This venerable work continues to be the most accessed and respected scientific reference in the world. An authoritative resource consisting of tables of data and current international recommendations on nomenclature, symbols, and units, its usefulness spans not only the physical sciences but also related areas of biology, geology, and environmental science. The 96th edition of the Handbook includes 18 new or updated tables along with other updates and expansions. A new series highlighting the achievements of some of the major historical figures in chemistry and physics was initiated with the 94th edition. This series is continued with this edition, which is focused on Lord Kelvin, Michael Faraday, John Dalton, and Robert Boyle. This series, which provides biographical information, a list of major achievements, and notable quotations attributed to each of the renowned chemists and physicists, will be continued in succeeding editions. Each edition will feature two chemists and two physicists. The 96th edition now includes a complimentary eBook with purchase of the print version. This reference puts physical property data and mathematical formulas used in labs and classrooms every day within easy reach. New Tables: Section 1: Basic Constants, Units, and Conversion Factors Descriptive Terms for Solubility Section 8: Analytical Chemistry Stationary Phases for Porous Layer Open Tubular Columns Coolants for Cryotrapping Instability of HPLC Solvents Chlorine-Bromine Combination Isotope Intensities Section 16: Health and Safety Information Materials Compatible with and Resistant to 72 Percent Perchloric Acid Relative Dose Ranges from Ionizing Radiation Updated and Expanded Tables Section 6: Fluid Properties Sublimation Pressure of Solids Vapor Pressure of Fluids at Temperatures Below 300 K Section 7: Biochemistry Structure and Functions of Some Common Drugs Section 9: Molecular Structure and Spectroscopy Bond Dissociation Energies Section 11: Nuclear and Particle Physics Summary Tables of Particle Properties Table of the Isotopes Section 14: Geophysics, Astronomy, and Acoustics Major World Earthquakes Atmospheric Concentration of Carbon Dioxide, 1958-2014 Global Temperature Trend, 1880-2014 Section 15: Practical Laboratory Data Dependence of Boiling Point on Pressure Section 16: Health and Safety Information Threshold Limits for Airborne Contaminants
Download or read book CRC Handbook of Chemistry and Physics 94th Edition written by William M. Haynes and published by CRC Press. This book was released on 2016-04-19 with total page 2640 pages. Available in PDF, EPUB and Kindle. Book excerpt: Celebrating the 100th anniversary of the CRC Handbook of Chemistry and Physics, this 94th edition is an update of a classic reference, mirroring the growth and direction of science for a century. The Handbook continues to be the most accessed and respected scientific reference in the science, technical, and medical communities. An authoritative resource consisting of tables of data, its usefulness spans every discipline. Originally a 116-page pocket-sized book, known as the Rubber Handbook, the CRC Handbook of Chemistry and Physics comprises 2,600 pages of critically evaluated data. An essential resource for scientists around the world, the Handbook is now available in print, eBook, and online formats. New tables: Section 7: Biochemistry Properties of Fatty Acid Methyl and Ethyl Esters Related to Biofuels Section 8: Analytical Chemistry Gas Chromatographic Retention Indices Detectors for Liquid Chromatography Organic Analytical Reagents for the Determination of Inorganic Ions Section 12: Properties of Solids Properties of Selected Materials at Cryogenic Temperatures Significantly updated and expanded tables: Section 3: Physical Constants of Organic Compounds Expansion of Diamagnetic Susceptibility of Selected Organic Compounds Section 5: Thermochemistry, Electrochemistry, and Solution Chemistry Update of Electrochemical Series Section 6: Fluid Properties Expansion of Thermophysical Properties of Selected Fluids at Saturation Major expansion and update of Viscosity of Liquid Metals Section 7: Biochemistry Update of Properties of Fatty Acids and Their Methyl Esters Section 8: Analytical Chemistry Major expansion of Abbreviations and Symbols Used in Analytical Chemistry Section 9: Molecular Structure and Spectroscopy Update of Bond Dissociation Energies Section 11: Nuclear and Particle Physics Update of Summary Tables of Particle Properties Section 14: Geophysics, Astronomy, and Acoustics Update of Atmospheric Concentration of Carbon Dioxide, 1958-2012 Update of Global Temperature Trend, 1880-2012 Major update of Speed of Sound in Various Media Section 15: Practical Laboratory Data Update of Laboratory Solvents and Other Liquid Reagents Major update of Density of Solvents as a Function of Temperature Major update of Dependence of Boiling Point on Pressure Section 16: Health and Safety Information Major update of Threshold Limits for Airborne Contaminants Appendix A: Major update of Mathematical Tables Appendix B: Update of Sources of Physical and Chemical Data
Download or read book Reference Data on Atoms Molecules and Ions written by A.A. Radzig and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 475 pages. Available in PDF, EPUB and Kindle. Book excerpt: This reference book contains information about the structure and properties of atomic and molecular particles, as well as some of the nuclear parameters. It includes data which can be of use when studying atomic and molecular processes in the physics of gases, chemistry of gases and gas optics, in plasma physics and plasma chemistry, in physical chemistry and radiation chemistry, in geophysics, astrophysics, solid-state physics and a variety of cross-discipli nary fields of science and technology. Our aim was to collect carefully selected and estimated numerical values for a wide circle of microscopic parameters in a relatively "not thick" book. These values are of constant use in the work of practical investigators. In essence, the book represents a substantially revised and extended edi tion of our reference book published in Russian in 1980. Two main reasons made it necessary to rework the material. On the one hand, a great deal of new high-quality data has appeared in the past few years and furthermore we have enlisted many sources of information previously inaccessible to us. On the other hand, we have tried to insert extensive information on new, rapidly progressing branches of physical research, such as multiply charged ions, Rydberg atoms, van der Waals and excimer molecules, complex ions, etc. All this brings us to the very edge of studies being carried out in the field.
Download or read book CRC Handbook of Chemistry and Physics 85th Edition written by David R. Lide and published by CRC Press. This book was released on 2004-06-29 with total page 2900 pages. Available in PDF, EPUB and Kindle. Book excerpt: Get a FREE first edition facsimile with each copy of the 85th! Researchers around the world depend upon having access to authoritative, up-to-date data. And for more than 90 years, they have relied on the CRC Handbook of Chemistry and Physics for that data. This year is no exception. New tables, extensive updates, and added sections mean the Handbook has again set a new standard for reliability, utility, and thoroughness. This edition features a Foreword by world renowned neurologist and author Oliver Sacks, a free facsimile of the 1913 first edition of the Handbook, and thumb tabs that make it easier to locate particular data. New tables in this edition include: Index of Refraction of Inorganic Crystals Upper and Lower Azeotropic Data for Binary Mixtures Critical Solution Temperatures of Polymer Solutions Density of Solvents as a Function of Temperature By popular request, several tables omitted from recent editions are back, including Coefficients of Frictionand Miscibility of Organic Solvents. Ten other sections have been substantially revised, with some, such as the Table of the Isotopes and Thermal Conductivity of Liquids, significantly expanded. The Fundamental Physical Constants section has been updated with the latest CODATA/NIST values, and the Mathematical Tables appendix now features several new sections covering topics that include orthogonal polynomials Clebsch-Gordan coefficients, and statistics.
