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The Behavior of Molecules

Think about the different levels of activity in the rooms at your school. Some rooms are quiet, such as crowded classrooms where students are taking tests. No one moves much and everyone is seated in the room in some orderly fashion. Other rooms are loud and there is constant motion, such as the cafeteria at lunchtime. Everyone moves from place to place in no particular pattern. [Pg.12]

Each room in your school has its own set of predictable rules and behaviors, its own state of chaos. How students move, behave, and occupy a space determines the state of chaos. Once you learn the state of chaos for a given room at school (the test-taking room, for example), you can predict what the students will do in that room, or state. [Pg.12]

In the same way, the behavior of molecules in chemistry determines the state of matter, or phase of a substance. The state of matter tells you how molecules move, behave, and are organized in [Pg.12]

Before one can understand a state of matter, it s good to understand the basic definitions of matter and all of its parts. Matter, it turns out, includes everything on Earth. That is, anything that has mass and takes up space. Trees, books, and computers are all types of matter. So are air, steam, and stars. Matter comes in countless shapes and forms, and is made up of many different substances called elements. [Pg.13]

Elements are the most basic substances in the universe. They can only be broken down into their most basic components by scientists in a laboratory. Elements, however, do not usually break down naturally. Oxygen, carbon, and copper are all examples of elements. So are calcium, titanium, and seaborgium. Everything on Earth is made of elements. [Pg.13]


An improved version, called COSMO for realistic solvents (COSMO-RS), has also been created. This method has an improved scheme for modeling nonelectrostatic effects. It can be adapted for modeling the behavior of molecules in any solvent and, gives increased accuracy of results as compared to COSMO. [Pg.212]

The behavior of molecules trapped in a network satisfies us that we are on the right track we continue by applying this relaxation time to viscous behavior. [Pg.124]

The theory of chemical and physical hardnesses is useful because it unifies understanding of various properties and it connects the behaviors of molecules with those of liquids and solids. [Pg.190]

Understand the behavior of molecules and substances in unusual environments at extreme temperatures or pressures, absorbed on solid surfaces, or under shear flow. [Pg.41]

While excitation processes in strong laser fields have not received as much attention as ionization rates and high-harmonic generation, the study of excitation is an important aspect of our overall understanding of the behavior of molecules in strong laser fields. [Pg.17]

The logic and rigor of statistics also reside at the heart of modern science. Statistical evaluation is the first step in considering whether a body of measurements allows one to discriminate among rival models for a biochemical process. Beyond their value in experimental sciences, probabilistic considerations also help us to formulate theories about the behavior of molecules and particles and to conceptualize stochastic and chaotic events. [Pg.648]

Unlike liquids and solids, there are no forces holding molecules together in a gas. In fact, gas molecules are not particularly attracted to each other at all. The only thing that holds gas molecules together is the shape of the container around them (In the atmosphere, gases surround Earth due to Earths gravity.). The behavior of molecules in that container is not dependent on any special forces between atoms or molecules. Instead, temperature and pressure are the most important factors. [Pg.60]

Chemical imaging allows the behavior of molecules in nanochannels to be investigated by following the flow of fluorescent dyes. Behavior contrary to that observed in micro- and macrochannels is observed, demonstrating that this is a new and promising flow regime. [Pg.53]

Within a molecule, a nucleus is characterized by its magnetic properties and electronic environment and by the following consequent parameters associated with the corresponding NMR signals chemical shift, coupling constants, relaxation rates,15 and nuclear Overhauser enhancement (NOE).1617 All these values may be used to extract qualitative or quantitative information about the structure, the conformation, and the behavior of molecules in solution. [Pg.17]

II. Accelrys is a computational science company that develops and delivers scientific software applications and services to solve R D problems. They provide simulation and informatics software as well as a computational portfolio that combines modeling and visualization software to predict properties and interpret the behavior of molecules and materials and services. They adhere to an open, component-based software platform that can run across the network on Windows, Linux, or UNIX servers. [Pg.51]

Some games serve to duplicate the practical nature of chemistry rather than the behavior of molecules. In a peptide sequencing game, students must make wise choices as they try to sequence a protein by choosing which experiments and in which order they wish to have results from (Lemley 1989). [Pg.273]

Historically, the field of molecular dynamics (MD) evolved as a means of simulating the behavior of molecules in an attempt to reproduce and, hopefully, to predict structural, dynamic, and thermodynamic properties of molecules.78-80 In recent years, however, it has become popular as a means for refining molecular structures with respect to experimental data.81 This relies on the fact that if any system is simulated, it will tend to run downhill energetically... [Pg.158]

It seems to us reasonable to believe that cautious empirical projection and common sense still have a dominant role to play in forecasting the behavior of molecules with multiple bonds between metal atoms and that when these approaches come into conflict with the results of ab initio calculations, the latter should be viewed with reservations. [Pg.32]

The properties of a system based on the behavior of molecules are related to the microscopic state, which is the main concern of statistical thermodynamics. In contrast, classical thermodynamics formulate the macroscopic state, which is related to the average behavior of large groups of molecules leading to the definitions of macroscopic properties such as temperature and pressure. [Pg.2]

Wilsons equation and the modification proposed by Renon and Prausnitz (8) use the local mole fraction concept, produced because molecules in solution aggregate as a result of the variation in intermo-lecular forces. The local mole fraction concept results in a more useful description of the behavior of molecules in a non-ideal mixture. [Pg.104]


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