Solids, Liquids, and Gases
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Equations of State and Thermodynamics of Solids Using Empirical Corrections in the Quasiharmonic Approximation
PHYSICAL REVIEW B 84, 184103 (2011) Equations of state and thermodynamics of solids using empirical corrections in the quasiharmonic approximation A. Otero-de-la-Roza* and V´ıctor Luana˜ † Departamento de Qu´ımica F´ısica y Anal´ıtica, Facultad de Qu´ımica, Universidad de Oviedo, ES-33006 Oviedo, Spain (Received 24 May 2011; revised manuscript received 8 October 2011; published 11 November 2011) Current state-of-the-art thermodynamic calculations using approximate density functionals in the quasi- harmonic approximation (QHA) suffer from systematic errors in the prediction of the equation of state and thermodynamic properties of a solid. In this paper, we propose three simple and theoretically sound empirical corrections to the static energy that use one, or at most two, easily accessible experimental parameters: the room-temperature volume and bulk modulus. Coupled with an appropriate numerical fitting technique, we show that experimental results for three model systems (MgO, fcc Al, and diamond) can be reproduced to a very high accuracy in wide ranges of pressure and temperature. In the best available combination of functional and empirical correction, the predictive power of the DFT + QHA approach is restored. The calculation of the volume-dependent phonon density of states required by QHA can be too expensive, and we have explored simplified thermal models in several phases of Fe. The empirical correction works as expected, but the approximate nature of the simplified thermal model limits significantly the range of validity of the results. DOI: 10.1103/PhysRevB.84.184103 PACS number(s): 64.10.+h, 65.40.−b, 63.20.−e, 71.15.Nc I. -
VISCOSITY of a GAS -Dr S P Singh Department of Chemistry, a N College, Patna
Lecture Note on VISCOSITY OF A GAS -Dr S P Singh Department of Chemistry, A N College, Patna A sketchy summary of the main points Viscosity of gases, relation between mean free path and coefficient of viscosity, temperature and pressure dependence of viscosity, calculation of collision diameter from the coefficient of viscosity Viscosity is the property of a fluid which implies resistance to flow. Viscosity arises from jump of molecules from one layer to another in case of a gas. There is a transfer of momentum of molecules from faster layer to slower layer or vice-versa. Let us consider a gas having laminar flow over a horizontal surface OX with a velocity smaller than the thermal velocity of the molecule. The velocity of the gaseous layer in contact with the surface is zero which goes on increasing upon increasing the distance from OX towards OY (the direction perpendicular to OX) at a uniform rate . Suppose a layer ‘B’ of the gas is at a certain distance from the fixed surface OX having velocity ‘v’. Two layers ‘A’ and ‘C’ above and below are taken into consideration at a distance ‘l’ (mean free path of the gaseous molecules) so that the molecules moving vertically up and down can’t collide while moving between the two layers. Thus, the velocity of a gas in the layer ‘A’ ---------- (i) = + Likely, the velocity of the gas in the layer ‘C’ ---------- (ii) The gaseous molecules are moving in all directions due= to −thermal velocity; therefore, it may be supposed that of the gaseous molecules are moving along the three Cartesian coordinates each. -
Viscosity of Gases References
VISCOSITY OF GASES Marcia L. Huber and Allan H. Harvey The following table gives the viscosity of some common gases generally less than 2% . Uncertainties for the viscosities of gases in as a function of temperature . Unless otherwise noted, the viscosity this table are generally less than 3%; uncertainty information on values refer to a pressure of 100 kPa (1 bar) . The notation P = 0 specific fluids can be found in the references . Viscosity is given in indicates that the low-pressure limiting value is given . The dif- units of μPa s; note that 1 μPa s = 10–5 poise . Substances are listed ference between the viscosity at 100 kPa and the limiting value is in the modified Hill order (see Introduction) . Viscosity in μPa s 100 K 200 K 300 K 400 K 500 K 600 K Ref. Air 7 .1 13 .3 18 .5 23 .1 27 .1 30 .8 1 Ar Argon (P = 0) 8 .1 15 .9 22 .7 28 .6 33 .9 38 .8 2, 3*, 4* BF3 Boron trifluoride 12 .3 17 .1 21 .7 26 .1 30 .2 5 ClH Hydrogen chloride 14 .6 19 .7 24 .3 5 F6S Sulfur hexafluoride (P = 0) 15 .3 19 .7 23 .8 27 .6 6 H2 Normal hydrogen (P = 0) 4 .1 6 .8 8 .9 10 .9 12 .8 14 .5 3*, 7 D2 Deuterium (P = 0) 5 .9 9 .6 12 .6 15 .4 17 .9 20 .3 8 H2O Water (P = 0) 9 .8 13 .4 17 .3 21 .4 9 D2O Deuterium oxide (P = 0) 10 .2 13 .7 17 .8 22 .0 10 H2S Hydrogen sulfide 12 .5 16 .9 21 .2 25 .4 11 H3N Ammonia 10 .2 14 .0 17 .9 21 .7 12 He Helium (P = 0) 9 .6 15 .1 19 .9 24 .3 28 .3 32 .2 13 Kr Krypton (P = 0) 17 .4 25 .5 32 .9 39 .6 45 .8 14 NO Nitric oxide 13 .8 19 .2 23 .8 28 .0 31 .9 5 N2 Nitrogen 7 .0 12 .9 17 .9 22 .2 26 .1 29 .6 1, 15* N2O Nitrous -
States of Matter Lesson
National Aeronautics and Space Administration STATES OF MATTER NASA SUMMER OF INNOVATION LESSON DESCRIPTION UNIT This lesson explores the states of matter Physical Science—States of Matter and their properties. GRADE LEVELS OBJECTIVES 4 – 6 Students will CONNECTION TO CURRICULUM • Simulate the movement of atoms and molecules in solids, liquids, Science and gases TEACHER PREPARATION TIME • Demonstrate the properties of 2 hours liquids including density and buoyancy LESSON TIME NEEDED • Investigate how the density of a 4 hours Complexity: Moderate solid behaves in varying densities of liquids • Construct a rocket powered by pressurized gas created from a chemical reaction between a solid and a liquid NATIONAL STANDARDS National Science Education Standards (NSTA) Science and Technology • Abilities of technological design • Understanding science and technology Physical Science • Position and movement of objects • Properties and changes in properties of matter • Transfer of energy MANAGEMENT For the first activity you may need to enhance prior knowledge about matter and energy from a supplemental handout called “Diagramming Atoms and Molecules in Motion.” At the middle school level, this information about the invisible world of the atom is often presented as a story which we ask them to accept without much ready evidence. Since so many middle school students have not had science experience at the concrete operational level, they are poorly equipped to work at an abstract level. However, in this activity students can begin to see evidence that supports the abstract information you are sharing with them. They can take notes on the first two descriptions as you present on the overhead. Emphasize the spacing of the particles, rather than the number. -
Sounds of a Supersolid A
NEWS & VIEWS RESEARCH hypothesis came from extensive population humans, implying possible mosquito exposure long-distance spread of insecticide-resistant time-series analysis from that earlier study5, to malaria parasites and the potential to spread mosquitoes, worsening an already dire situ- which showed beyond reasonable doubt that infection over great distances. ation, given the current spread of insecticide a mosquito vector species called Anopheles However, the authors failed to detect resistance in mosquito populations. This would coluzzii persists locally in the dry season in parasite infections in their aerially sampled be a matter of great concern because insecticides as-yet-undiscovered places. However, the malaria vectors, a result that they assert is to be are the best means of malaria control currently data were not consistent with this outcome for expected given the small sample size and the low available8. However, long-distance migration other malaria vectors in the study area — the parasite-infection rates typical of populations of could facilitate the desirable spread of mosqui- species Anopheles gambiae and Anopheles ara- malaria vectors. A problem with this argument toes for gene-based methods of malaria-vector biensis — leaving wind-powered long-distance is that the typical infection rates they mention control. One thing is certain, Huestis and col- migration as the only remaining possibility to are based on one specific mosquito body part leagues have permanently transformed our explain the data5. (salivary glands), rather than the unknown but understanding of African malaria vectors and Both modelling6 and genetic studies7 undoubtedly much higher infection rates that what it will take to conquer malaria. -
Multidisciplinary Design Project Engineering Dictionary Version 0.0.2
Multidisciplinary Design Project Engineering Dictionary Version 0.0.2 February 15, 2006 . DRAFT Cambridge-MIT Institute Multidisciplinary Design Project This Dictionary/Glossary of Engineering terms has been compiled to compliment the work developed as part of the Multi-disciplinary Design Project (MDP), which is a programme to develop teaching material and kits to aid the running of mechtronics projects in Universities and Schools. The project is being carried out with support from the Cambridge-MIT Institute undergraduate teaching programe. For more information about the project please visit the MDP website at http://www-mdp.eng.cam.ac.uk or contact Dr. Peter Long Prof. Alex Slocum Cambridge University Engineering Department Massachusetts Institute of Technology Trumpington Street, 77 Massachusetts Ave. Cambridge. Cambridge MA 02139-4307 CB2 1PZ. USA e-mail: [email protected] e-mail: [email protected] tel: +44 (0) 1223 332779 tel: +1 617 253 0012 For information about the CMI initiative please see Cambridge-MIT Institute website :- http://www.cambridge-mit.org CMI CMI, University of Cambridge Massachusetts Institute of Technology 10 Miller’s Yard, 77 Massachusetts Ave. Mill Lane, Cambridge MA 02139-4307 Cambridge. CB2 1RQ. USA tel: +44 (0) 1223 327207 tel. +1 617 253 7732 fax: +44 (0) 1223 765891 fax. +1 617 258 8539 . DRAFT 2 CMI-MDP Programme 1 Introduction This dictionary/glossary has not been developed as a definative work but as a useful reference book for engi- neering students to search when looking for the meaning of a word/phrase. It has been compiled from a number of existing glossaries together with a number of local additions. -
Specific Latent Heat
SPECIFIC LATENT HEAT The specific latent heat of a substance tells us how much energy is required to change 1 kg from a solid to a liquid (specific latent heat of fusion) or from a liquid to a gas (specific latent heat of vaporisation). �����푦 (��) 퐸 ����������푐 ������� ℎ���� �� ������� �� = (��⁄��) = 푓 � ����� (��) �����푦 = ����������푐 ������� ℎ���� �� 퐸 = ��푓 × � ������� × ����� ����� 퐸 � = �� 푦 푓 ����� = ����������푐 ������� ℎ���� �� ������� WORKED EXAMPLE QUESTION 398 J of energy is needed to turn 500 g of liquid nitrogen into at gas at-196°C. Calculate the specific latent heat of vaporisation of nitrogen. ANSWER Step 1: Write down what you know, and E = 99500 J what you want to know. m = 500 g = 0.5 kg L = ? v Step 2: Use the triangle to decide how to 퐸 ��푣 = find the answer - the specific latent heat � of vaporisation. 99500 퐽 퐿 = 0.5 �� = 199 000 ��⁄�� Step 3: Use the figures given to work out 푣 the answer. The specific latent heat of vaporisation of nitrogen in 199 000 J/kg (199 kJ/kg) Questions 1. Calculate the specific latent heat of fusion if: a. 28 000 J is supplied to turn 2 kg of solid oxygen into a liquid at -219°C 14 000 J/kg or 14 kJ/kg b. 183 600 J is supplied to turn 3.4 kg of solid sulphur into a liquid at 115°C 54 000 J/kg or 54 kJ/kg c. 6600 J is supplied to turn 600g of solid mercury into a liquid at -39°C 11 000 J/kg or 11 kJ/kg d. -
Glossary of Terms
GLOSSARY OF TERMS For the purpose of this Handbook, the following definitions and abbreviations shall apply. Although all of the definitions and abbreviations listed below may have not been used in this Handbook, the additional terminology is provided to assist the user of Handbook in understanding technical terminology associated with Drainage Improvement Projects and the associated regulations. Program-specific terms have been defined separately for each program and are contained in pertinent sub-sections of Section 2 of this handbook. ACRONYMS ASTM American Society for Testing Materials CBBEL Christopher B. Burke Engineering, Ltd. COE United States Army Corps of Engineers EPA Environmental Protection Agency IDEM Indiana Department of Environmental Management IDNR Indiana Department of Natural Resources NRCS USDA-Natural Resources Conservation Service SWCD Soil and Water Conservation District USDA United States Department of Agriculture USFWS United States Fish and Wildlife Service DEFINITIONS AASHTO Classification. The official classification of soil materials and soil aggregate mixtures for highway construction used by the American Association of State Highway and Transportation Officials. Abutment. The sloping sides of a valley that supports the ends of a dam. Acre-Foot. The volume of water that will cover 1 acre to a depth of 1 ft. Aggregate. (1) The sand and gravel portion of concrete (65 to 75% by volume), the rest being cement and water. Fine aggregate contains particles ranging from 1/4 in. down to that retained on a 200-mesh screen. Coarse aggregate ranges from 1/4 in. up to l½ in. (2) That which is installed for the purpose of changing drainage characteristics. -
Chapter 3 3.4-2 the Compressibility Factor Equation of State
Chapter 3 3.4-2 The Compressibility Factor Equation of State The dimensionless compressibility factor, Z, for a gaseous species is defined as the ratio pv Z = (3.4-1) RT If the gas behaves ideally Z = 1. The extent to which Z differs from 1 is a measure of the extent to which the gas is behaving nonideally. The compressibility can be determined from experimental data where Z is plotted versus a dimensionless reduced pressure pR and reduced temperature TR, defined as pR = p/pc and TR = T/Tc In these expressions, pc and Tc denote the critical pressure and temperature, respectively. A generalized compressibility chart of the form Z = f(pR, TR) is shown in Figure 3.4-1 for 10 different gases. The solid lines represent the best curves fitted to the data. Figure 3.4-1 Generalized compressibility chart for various gases10. It can be seen from Figure 3.4-1 that the value of Z tends to unity for all temperatures as pressure approach zero and Z also approaches unity for all pressure at very high temperature. If the p, v, and T data are available in table format or computer software then you should not use the generalized compressibility chart to evaluate p, v, and T since using Z is just another approximation to the real data. 10 Moran, M. J. and Shapiro H. N., Fundamentals of Engineering Thermodynamics, Wiley, 2008, pg. 112 3-19 Example 3.4-2 ---------------------------------------------------------------------------------- A closed, rigid tank filled with water vapor, initially at 20 MPa, 520oC, is cooled until its temperature reaches 400oC. -
Thermal Properties of Petroleum Products
UNITED STATES DEPARTMENT OF COMMERCE BUREAU OF STANDARDS THERMAL PROPERTIES OF PETROLEUM PRODUCTS MISCELLANEOUS PUBLICATION OF THE BUREAU OF STANDARDS, No. 97 UNITED STATES DEPARTMENT OF COMMERCE R. P. LAMONT, Secretary BUREAU OF STANDARDS GEORGE K. BURGESS, Director MISCELLANEOUS PUBLICATION No. 97 THERMAL PROPERTIES OF PETROLEUM PRODUCTS NOVEMBER 9, 1929 UNITED STATES GOVERNMENT PRINTING OFFICE WASHINGTON : 1929 F<ir isale by tfttf^uperintendent of Dotmrtients, Washington, D. C. - - - Price IS cants THERMAL PROPERTIES OF PETROLEUM PRODUCTS By C. S. Cragoe ABSTRACT Various thermal properties of petroleum products are given in numerous tables which embody the results of a critical study of the data in the literature, together with unpublished data obtained at the Bureau of Standards. The tables contain what appear to be the most reliable values at present available. The experimental basis for each table, and the agreement of the tabulated values with experimental results, are given. Accompanying each table is a statement regarding the esti- mated accuracy of the data and a practical example of the use of the data. The tables have been prepared in forms convenient for use in engineering. CONTENTS Page I. Introduction 1 II. Fundamental units and constants 2 III. Thermal expansion t 4 1. Thermal expansion of petroleum asphalts and fluxes 6 2. Thermal expansion of volatile petroleum liquids 8 3. Thermal expansion of gasoline-benzol mixtures 10 IV. Heats of combustion : 14 1. Heats of combustion of crude oils, fuel oils, and kerosenes 16 2. Heats of combustion of volatile petroleum products 18 3. Heats of combustion of gasoline-benzol mixtures 20 V. -
Liquid Crystals
www.scifun.org LIQUID CRYSTALS To those who know that substances can exist in three states, solid, liquid, and gas, the term “liquid crystal” may be puzzling. How can a liquid be crystalline? However, “liquid crystal” is an accurate description of both the observed state transitions of many substances and the arrangement of molecules in some states of these substances. Many substances can exist in more than one state. For example, water can exist as a solid (ice), liquid, or gas (water vapor). The state of water depends on its temperature. Below 0̊C, water is a solid. As the temperature rises above 0̊C, ice melts to liquid water. When the temperature rises above 100̊C, liquid water vaporizes completely. Some substances can exist in states other than solid, liquid, and vapor. For example, cholesterol myristate (a derivative of cholesterol) is a crystalline solid below 71̊C. When the solid is warmed to 71̊C, it turns into a cloudy liquid. When the cloudy liquid is heated to 86̊C, it becomes a clear liquid. Cholesterol myristate changes from the solid state to an intermediate state (cloudy liquid) at 71̊C, and from the intermediate state to the liquid state at 86̊C. Because the intermediate state exits between the crystalline solid state and the liquid state, it has been called the liquid crystal state. Figure 1. Arrangement of Figure 2. Arrangement of Figure 3. Arrangement of molecules in a solid crystal. molecules in a liquid. molecules in a liquid crystal. “Liquid crystal” also accurately describes the arrangement of molecules in this state. In the crystalline solid state, as represented in Figure 1, the arrangement of molecules is regular, with a regularly repeating pattern in all directions. -
Solid 4He: Search for Superfluidity
Solid 4He : search for superfluidity G. Bonfait, H. Godfrin, B. Castaing To cite this version: G. Bonfait, H. Godfrin, B. Castaing. Solid 4He : search for superfluidity. Journal de Physique, 1989, 50 (15), pp.1997-2002. 10.1051/jphys:0198900500150199700. jpa-00211043 HAL Id: jpa-00211043 https://hal.archives-ouvertes.fr/jpa-00211043 Submitted on 1 Jan 1989 HAL is a multi-disciplinary open access L’archive ouverte pluridisciplinaire HAL, est archive for the deposit and dissemination of sci- destinée au dépôt et à la diffusion de documents entific research documents, whether they are pub- scientifiques de niveau recherche, publiés ou non, lished or not. The documents may come from émanant des établissements d’enseignement et de teaching and research institutions in France or recherche français ou étrangers, des laboratoires abroad, or from public or private research centers. publics ou privés. 1bme 50 N° 15 1er AOUT 1989 LE JOURNAL DE PHYSIQUE J. Phys. France 50 (1989) 1997-2002 1er AOUT 1989, 1997 Classification Physics Abstracts 67.80 Short Communication Solid 4He : search for superfluidity G. Bonfait (1)(*), H. Godfrin (1,2) and B. Castaing (1) (1) CRTBT.-C.N.R.S., Laboratoire associé à l’Université Joseph Fourier, B.P. 166 X, 38042 Grenoble Cedex, France (2) ILL, B.P. 156 X, 38042 Grenoble Cedex, France (Reçu le 17 avril 1989, accepté sous forme définitive le 30 mai 1989) Résumé. 2014 L’existence d’une superfluidité pour un solide de bosons a été proposée par plusieurs théoriciens. Aucune expérience ne l’a jusqu’à présent révélée. Nous présentons un argument qui nous a incités à explorer la gamme de température 1 mK-20 mK.