McQueen Lab
Quantum Materials Research Group

+Solid State Chemistry Basic Solid State Chemistry, 2nd Ed. (West 1996) The Chemistry of Quantum Materials (McQueen 2023) Introduction to Solid-state Chemistry (MIT) Introduction to Crystal Physics (Hartmann) The Nature of Crystalline Solids Properties of Materials (Newnham) Inorganic Structural Chemistry 2nd Ed. (Muller) Solid State Physics (Ashcroft and Mermin) [Alternative Version] Group Theory for Chemists (Davidson 1991) Groups and Double Groups (Atkins 2006) Group Theory Applications to the Physics of Condensed Matter (Dresselhaus 2008) Oxides: Solid-state Chemistry (McCarroll/Ramanujachary) Introduction to Phase Equilibria and Phase Diagrams Introduction to Ternary Phase Diagrams (Selvaduray 2004) Exploratory Synthesis of New Compounds (Corbett, 2006) List of Solid State References The WKB Approximation Process Engineering Analysis in Semiconductor Device Fabrication Quantum Mechanics Notes (Silverstone) Physical Chemistry, 8th Ed. (Atkins) Discovery and History of the Tl2S Photocell (Cashman) Chemical Kinetics and Reaction Mechanisms, 2nd Ed. (Espenson) Everything you need to know about science (Packard Fellows 1999) Sample GBO/Orals/Thesis Proposal Guide to Acing Oral Exams Efficient Reading of Papers in Science and Technology +Solid State Chemistry: Course Notes The Nature of the Chemical Bond Chemical Structure: Packing of Spheres and Unit Cells Important Structure Types and Polyhedra Defects in Solids Diffraction Thermodynamics of Solids Magnetic Properties of Solids Electrical Properties Of Solids Electrons in Solids: Basic Bonding Electrons in Solids: Basic Band Structures Electrons in Solids: Correlated Electrons Electrons in Solids: Modern Techniques Coupling Degrees of Freedom Thermoelectrics Photovoltaics MIT Solid State Chemistry Lectures +Bonding in Solids Bonding in Metals, Semiconductors, and Insulators Classification of Mixed Valence Compounds (Robin and Day 1967) The Band Model for d- and f-METALS (Koelling) The Band Theory of Solids Bandgaps in Solids (Allen, 1985) Bonding in ThCr2Si2 Materials (Hoffman, 1985) Bonding in ThCr2Si2 versus CaBe2Ge2 (Hoffman, 1986) Charge and Spin Density Waves (Brown and Gruener, 1994) Resonating Valence Bonds (RVB) (Anderson, 1973); followup RVB as triangular antiferromagnet ground state (Anderson 1973) Beyond the Bond (Philip Ball, 2011) Half-filled 1-D Chain from HL States (Hashimoto) HL versus HF Wavefunctions Local and Cooperative Jahn-Teller Distortions in Solids First vs Second Order Jahn-Teller Effects (Pearson 1975) Second Order Jahn-Teller Examples (Pearson 1983) A Bonding Quandary Relativistic Effects on Bonding (Desclaux 1979) The Nature of Electron Localization (MacKinnon 1993) DO OXIDATION STATES HAVE PHYSICAL MEANING? CONFLICTING VIEWS: Charge States in Transition (Resta 2008) Charge Self Regulation (Zunger 2008) A Piece of the Picture (Jansen and Wedig 2008) Oxidation States, Atomic Charges, and Orbital Populations (Alvarez 2009) Rigorous definition of oxidation dates of ions in solids (Rapp 2011) +Structures and Structure Types Handbook of Layered Materials(Auerbach 2004) Perovskite Tiling Notation (Glazer 1972) Ruthenium Oxychlorides (Abraham, 2003) Review of Pyrochlores (Subramanian, 1983) Skutterudites: Survey (Fleurial 1997), Filled Variants (Sales 2003), Structure and Properties (Uher 2003) Perovskites, Especially Halide (Seshadri 2016) Instabilities in Layered Hexagonal Materials (Felser, 1998) Crystal Chemistry of Garnets (Geller, 1967); and List of All Known Garnets Iron Chalcogenides (Schwarz 2017) One Dimensional Chalcogenides (Francesconi 2011) List of All Known Crystal Structure Transitions (Tomaszewski, 1991) Misfit Layered Structures (Wiegers 1996) Misfit Layered Chalcogenides (Wiegers 1995) Misfit Layered Compounds (Meerschaut 1996) Rare earth oxides and zirconates phase diagrams (Jorba 1962) Zirconium pyrochlores and fluorites (Aldinger 2007) Aurivillius Phases for Oxygen Ion Conductors (H.-C. zur Loye 1996) Inorganic Selenides and Tellurides (Kolis 1993) Elemental Sulfur and Sulfur-rich compounds (Steudel 2003) Inorganic Polysulfides (Studel 2003) Preparation and Crystal Growth of Layered Materials (Leith 1977) New Viewpoint on Alumina Scale Formation (Heuer 2011) +High Temperature Solid State Synthesis Phase Transformations in Metals and Alloys (Porter 1992) Overview of Crystal Growth (1971) Handbook of CrystalGrowth (Dhanaraj, 2010) Crystal Growth from High-T Solutions (Scheel 1991) Crystal Growth from High-T Solutions (Elwell and Scheel 1975/2011) Kinetic Mechanisms of Flux Crystal Growth Complex Oxide Crystal Growth (Wanklyn, 1972) Fluoride Flux Crystal Growth Image Furnace Growth of Functional Oxides (Koohpayeh, 2007) Fisk Crystal Growth Technique Beginners Guide to Flux Crystal Growth (Tachibana NIMS 2017) Flux Crystal Growth (Fisher and Analytis, 2012) Flux Crystal Growth of Intermetallics Refractory Crystal Growth from Metallic Melts (Gurin and Korsukova, 1983) Handbook of Crystal Growth (Dhanaraj, et al.) Common Flux Etchants Flux Separation Methods (Wolf 2012) Crystallization (Mullin 2001) Chemical Vapor Transport Introduction (Binnewies 2012) Preparation of Pure Solids of Rare Elements Chemical Synthesis of Inorganic Materials (Rao 1993) Random Rule Surface Growth (Mello 2015) Crystal Growth in Fluids (Voigtmann 2017) Quenching in Mercury: Degrees of Disorder in Li3Ni2NbO6 +Cyanide Chemistry Cyanide Work Procedure Alkali Metal Cyanides (Rubo, et al.) Cyanogen (Janz) +Low-Temperature Chemistry Purification of Many Inorganic Materials Intercalation Chemistry (Jacobson and Nazar, 2006) Powerful Oxidizing Agents (DiSalvo 1989) Chimie Douce Techniques Effective Drying of Organic Solvents (Bradley 2010) Perovskites by Design: A Toolbox of Solid-State Reactions (Schaak and Mallouk, 2002) From Electronic/Ionic Conductors to Superconductors: Control of Materials Properties (Schoellhorn, 1988) Li and Na Intercalation Chemistry (Gopalakrishnan, 1985) Chimie Douce Approaches to the Synthesis of Metastable Oxides (Gopalakrishnan, 1995) Recent progress in oxo- and fluoro- metallate chemistry Role of Ion Exchange in Solid State Chemistry (Clearfield 1988) Ionic Liquids as electrolytes (Stepniak, 2006) Ionic Liquids for Electrochemistry (Scroscati 2009) Solid State Synthesis Techniques Manifestations of Noninnocent Ligand Behavior (Kaim 2011) Grignard Reagents (Goodenough 2005) Air Sensitive Techniques (2010) Schlenk Tips and Tricks Freeze-Pump-Thaw +Electronic Structure Calculations A Chemists Guide to DFT (Koch & Holthausen) Hybrid Functionals (Becke) Limits of DFT (Cohen 2008) +Science Committee Reports An Accelerated, Data-Driven, Materials Discovery Future (NSF 2022) Automated Research Workflows For Accelerated Discovery: Closing the Knowledge Discovery Loop (NAS 2022) NSF Efforts to Achieve the Nations Vision for the Materials Genome Initiative: Designing Materials to Revolutionize and ENgineer Our Future (DMREF) (NAS 2023) Materials Genome Initiative Strategic Plan (OSTP 2021) Frontiers of Materials Research: A Decadal Survey (NAS 2019) National Strategic Plan for Quantum Information Science (OSTP 2018) Future Directions in Quantum Information Processing (DoD 2017) Quantum Materials for Energy Relevant Technologies (DoE BRN 2017) Future Directions of Quantum Information Processing (DoD 2017) Frontiers in Crystalline Matter (NAP 2009) Research Opportunities in New Energy-related Materials (Warren and Geballe) New Science for a Sustainable Energy Future (DoE, 2008) Basic Research Needs for Superconductivity (DoE, 2006) Future Directions in Solid State Chemistry (2002 NSF Workshop Report) Neutron Scattering: Materials Research for Modern Life (STFC 2012) Patrick Stewart on the Importance of Neutrons and the ESS Physics of Life (NAS 2022)

+Quantum Materials Metals Without Electrons: the Physics of Exotic Quantum Fluids (Introduction to Electron Correlations, Schofield) The Chemistry of Quantum Materials (McQueen 2023) Novel electronic states close to Mott transition in low-dimensional and frustrated systems (Khomskii 2011) Correlated Electron Physics in Perovskites (Tokura 2003) Exotic Spin Texture Materials Metal-Insulator Transitions (Imada/Fujimori/Tokura) Metal-Insulator Transitions in Oxides (Honig and Van Zandt, 1975) Metal-Insulator Transition (Mott 1968) Electron Correlations in Narrow Energy Bands: An Improved Solution (Hubbard 1964) Characteristics of Heavy Fermions (Ott) Universal Kadowaki-Woods Ratio Wilson Ratio in Kondo Systems (Wilson 1975) Wilson Ratio in Heavy Fermions (Sheng and Cooper 1995) Role of Orbitals in Correlated Electron Systems (Khomskii, 2005) Disordered Electronic Systems (Lee and Ramakrishnan 1985) Spin and Orbital Ordering Types Jahn-Teller Distortions of Tetrahedral Site Ions (Goodenough 1963) Orbital Interactions in Low Dimensional Solids (Whangbo 1986) Magneto-optical properties of Spinels (Tokura, 2008) Introduction to the Electron Theory of Metals (Mizutani 2001) The Anomalous Hall Effect (Ong 2009) Quantum Hall Effect (Gooth 2020) Water Splitting with Oxides (Lee, 2006) Lithium Ion Battery Challenges (Tarascon, 2001) Determining Magnetocaloric Effect from Magnetization and Specific Heat, With Error Propagation (Pecharsky 1999) Quantum Algorithm Implementation for Beginners (Eidenben 2018) Fundamentals of Quantum Materials (2021) +2023 Principles and Applications of Symmetry in Magnetism Summer School Symmetry, Topology, Magnetic Topological Quantum Chemistry (Bradlyn): Lecture 1, Lecture 2, Lecture 3, Lecture 4, (Slides) Invariant theory and character table analysis applied to magnetism and spin-orbitronics (Manchon): Lecture 1, Lecture 2, Lecture 3a, Lecture 3b, Lecture 4 (Slides) Topological and multipolar magnets and spintronics (Nakatsuji): Lecture 1, Lecture 2, Lecture 3, Lecture 4 (Slides) Field theory of collinear and noncollinear magnetic order (Tchernyshyov): Lecture 1, Lecture 2, Lecture 3, Lecture 4, Lecture 5a, Lecture 5b (Slides) Responses in antiferromagnets; non-relativistic symmetry analysis (Zelezny): Lecture 1, Lecture 2, Lecture 3, Lecture 4, Lecture 5 (Slides) +Topological Insulators Topological Semimetals (Schoop 2018) Weyl and Dirac Semimetals in Three Dimensional Solids (Armitage, et al. 2017) Topological Quantum Chemistry and Band Representations (Felser, Bernevig, et al. 2017) Majorana Fermions and Topological Superconductivity (Leijnse and Flensberg 2012) Topological Superconductors: A review (Sato and Ando 2017) Complete Theory of Symmetry-based Indicators of Band Topology and Extended to all 1651 Magnetic Groups (Vishwanath, et al. 2017) Identification of a TI through the Bulk Bandstructure (Felser 2012) Quasi-Molecular Orbitals in Iridates (Khomskii 2012) Volovik on Topological States: 3He (2011), 3He (2005), and Physics, Gravity, and High-Tc Berry Phase (Berry 1984) Emergent Topological Phases in t2g-orbital Systems (Ting 2014) Z2 classification and 3-D Topological Insulators (Roy 2006(9)) Overview of Topological Insulators (Hasan, APS 2011) Cd3As2: A Dirac Semimetal (Cava 2013, Hasan 2013) Topological Phase Transitions in Skutterudites (Liu 2013) Superconductivity in Noncentrosymmetric PbTaSe2 (Cava 2013) The Birth of Topological Insulators (Moore 2010) Spin-Orbit Physics in the Mott Regime (Balents 2010) A Romance with Many Dimensions (Manoharan 2010) Classification of Interacting 3-D Topological Insulators (Senthil 2014) Interplay of Spin-Orbit Coupling and Magnetism (Whangbo 2008) Basics of Spectroscopic Term Symbols Simple Spin-Orbit Coupling Model for Chemists TIs and Thermoelectrics (Felser and Yan, 2012) Why is Mercury Liquid? (Importance of Spin Orbit Coupling) Spin-Orbit Coupling Constants for Atoms and Ions Spectroscopic Term Symbol Splitting in Crystals (group theory method) (Bethe 1929) Double groups at symmetry groups for spin-orbit hamiltonians (Damhus 1984) Opportunities in TIs (Cui 2011) Topological and Weyl Phonons (Lubensky 2016) The Molecular Berry Phase (Mead 1992) Diabolical Conical Intersections (Yarkony 1996) Quantum Computation by Braiding (Collins 2006, Scientific American) Quantum Computing With a Twist (Simon 2010, Physics World) +Magnetism Introduction to Magnetism Magnetic Properties of Solids (Dresselhaus) Electric and Magnetic Images Magnetism and the Chemical Bond (Goodenough 1963) Elemental Core Diamagnetism: List 1, List 2, List 3 Bond Diamagnetism: Pascal Constants Goodnough-Kanamori Superexchange Rules Origin of Magnetic Interactions by Studying Dimers (Hoffman 1975) Basic Models of Magnetic Susceptibility Magnetic Properties of Copper Dimers (Ginsberg 1967) Field Guide to Spin Liquids (Knolle and Moessner) Magnetic Pyrochlore Oxides (Greedan 2010) Geometrically Frustrated Magnets (Ramirez 1994) Spin liquids in frustrated magnets (Balents 2010) Frontiers in Frustrated Magnetism (Normand 2009) The Geometries of Triangular Magnetic Lattices (Cava, McQueen, et al.) Inosov Magnetism in Minerals: 2018 Version, 2019 Version Spin Hamiltonians and Exchange Interactions (Henley, Physics Perspective) Magnetic properties and Mott transition in the Hubbard model on the anisotropic triangular lattice (Yamada 2014) Spin-Orbit vs. Spin-Liquid on the Triangular Lattice (Balents 2017) Magnetic Frustration and Heavy Fermions (Broholm, 2004) The Design and Synthesis of Frustrated Magnets (Harrison 2004) Review of Triangular Antiferromagnets (Collins, 1997); the cond mat version is also available Properties of Magnetically Frustrated Pyrochlores (Chalker, 1998) Rare-Earth Pyrochlores (Rau, Gingras 2018) Theories on the Magnetic Properties of Solids (Koide and Oguchi, 1963) Pauling's (in)famous Ice Rules (Pauling, 1935) Quantum Skyrmionics Itinerant Magnetism from a Chemical Bonding Perspective (Dronskowski 2002; Alternate version also available) Molecular Magnetism (Sessoli, 2008) S=1/2 Magnetic Cluster Observables (Barnes 2005) Pd(dmit)2 Organic Magnets (Tamura 2009) F-element Molecular Magnetism (Long, 2011) NMR and Relaxation Rates in Dimers (Clementi 1998) Exchange Coupling in Clusters (Ginsberg 1971) Perimeter Institute Workshop on Frustrated Magnetism Handbook of Magnetic Materials (Buschow 1998) Magnetic Properties of Transition Metal Compounds (Carlin 1977) Magnetic Unit Conversions Excellent Overview of Magnetic Units (Birge 1934) Description of Magnetic Units Kotani Behavior (Impact of Spin-Orbit Coupling, Kotani, 1949) Thoughts on Curie-Weiss Law (Van Vleck, 1973) CURIE-WEISS FITTING TUTORIAL -> Analyzing Data using the Curie-Weiss Law (McQueen, 2009) -> Data used in the example -> Lattice Parameters vs Doping for Ruby (Graham, 1960) Spin-disorder Effects in Electrical Resistivities (Coles 1980) +Superconductivity List of Known Superconductors (More recent list of Intermetallic Superconductors) Russian List of Known Superconductors And Their Preparation (Savitskii 1973) Matthias on Superconductivity (includes list) Layered d-metal pnictide oxides and their potential as candidates for new superconductors (Kauzlarich, 2010) Unconventional Superconductors Comparison (Uemura, 2009) Neutron Studies of Pnictide Superconductors (Lynn, 2009) Current Status of Arsenide/Pnictide Superconductors (Hosono, 2008) Iron Chalcogenide Superconductivity (Dagotto 2013) Organic Conductors and Superconductors (Jerome, 2008) Design of a Room Temperature Superconductor (Pickett, 2006) Mechanisms of Superconductivity (with real data!) (Uemura, 2004) Interaction of superconductivity and magnetism in borocarbide superconductors (Narozhnyi 2001) Review of Oxide Superconductors (Cava, 2000) Organic Superconductors (Williams, 1991) Manifesto for a higher Tc - lessons from pnictides and cuprates (Basov and Chubukov 2011; expanded version of Nat. Phys. 2011 viewpoint Interplay between magnetism and superconductivity in iron-chalcogenide superconductors: crystal growth and characterizations (Birgeneau 2011) High Tc Predictions (Ericsson 2011) Possible Microscopic Origin of the Pseudogap (Goddard 2011) Meissner Effect in Anisotropic Superconductors (Millis 1987) Dynamical Correlations for High-Tc (Yin 2011) W-H-H Critical Field Formulas (WHH 1965) Superconductor Critical Fields: Numerical Solutions vs Analytical Approximations Superconducting Gap Symmetries (Gorkov 1985) Superconductivity: Physics and Applications (Fossheim and Sudbo, 2004) Modern Trends in Superconductivity and Superfluidity (Kagan) Pauli Limits on Superconductivity More on Pauli Limits on Superconductivity +Thermoelectrics On the Best Bandstructure for Thermoelectric Performance (Lundstrom 2011) Thermoelectrics Neat the Mott Transition (Haule/Kotliar) Complex Thermoelectric Materials (Snyder/Toberer) Themoelectric Generation and Cooling (Di Salvo, 1999) +Phonons and Their Interactions Vibrational Thermodynamics of Materials (Fultz 2009) Electrons in Crystals (Bloch 1928) Electron Phonon Interactions (Frohlich 1950) Strong Electron Phonon Interactions (Migdal 1958) Superconductors and Electron Phonon Interactions (Eliashberg 1960) Perspective on Migdal-Eliashberg Theory (Allen and Mitrovic 1982) +Potential Applications Gas Turbine Technology (Spittle 2003)

+Sample Measurements Cryogenic Thermal Conductivity of Greases and Polymers (Kreitman and Callahan 1970) Demagnetization Corrections: Cylinders, Simple Shapes Ferroelectric Bananas: A Cautionary Tale Non-Electronic Origins of T-linear Specific Heat Magnetocapacitance without magnetism in inhomogeneous materials (Parish 2012) SR830 Four-Probe Measurements Lockin Diagrams Four-Probe Resistivity Correction Factors: Bars, Circles, and General Shapes Method for Making Four-Probe Contacts to sub-mm Crystals Common Thermocouple Materials Voltage-to-Current Converter Some Experimental Methods and Tricks (Corbino Geometry, etc.) Carrier Concentrations from Hall Coefficients (B. Trump) Magnetoresistance of Metals (Pippard 1989) Non-constant DOS Variable Range Hopping (fishy...) Horowitz and Hill Art of Electronics (2nd Ed., 3rd Ed.) Electronic Properties of Doped Semiconductors (Shklovskii and Efros) Introduction to SQUIDs (Clarke, 1994) BTK Point Contact Junction Model Theoretical Model Point Contact Spectroscopy (Phillips 2014) Point Contact Spectroscopy of Multigap Superconductors (Daghero 2010) The Specific Heat of Matter at Low Temperatures (Tari) Specific Heat of Matter at Low Temperatures (Gopal, 1966) Dual Slope Heat Capacity Technique (Black 2010) Simple Heat Flow Model for the semi-adiabatic heat capacity method Semi-Adiabatic Heat Capacity Notes Measurement of Carrier Lifetimes Moessbauer Electric Field Gradient (EFG) And Crystal Field Some EPR Notes: EPR Line Shapes (Dattagupta-Blume 1974), EPR of Complex Molecules (Palmer 1993) Parr Hydrothermal Reaction Vessel Safety and Usage Two-Component Epoxies PPMS Uniaxial Stress Puck (Courtesy S. Stemmer, UCSB) Calculation of particle size and correlation length from peak width Calculation of neutron scattering interaction time Extracting Phonon DOS from Specific Heat (Loram 1986) Extracting Phonon DOS from Specific Heat (Kok 1990) Determination of Sulfide and Sulfate in Minerals (Vlisidis) A Lesson in Plant-Wide Process Control +Equipment Manuals Topas Quicksheet Glovebox User Manual Glovebox Regeneration Procedure ARCS Manual D8 Focus: Alignment Procedure (Verification worksheet), Startup/Shutdown Addendum D8 Advance: PheniX LowT Operation (Cryodrive Manual) PPMS/MPMS Liquid Helium Transfer Procedure PPMS Reverse Transfer (to warm Dewar) Restarting/Purging the Helium Reliquifier Scroll Tip Replacement Procedure Empty Straw Magnetization Data at 5 T Empty Straw M(H) at 2 and 300 K (Panella 2017) Alternate ACMS Extraction Method: ExtractACMS.py Using PPMS in Voltmeter Mode Oriel Chopper Manual High-T Vacuum Furnace Operation (Megatron) NHMFL Chip Schematic

+Structures and Crystallography Bond Valence Calculator: Excel Spreadsheet and associated List of Bond Valence Sum Constants (See also Brown BVS and Lufaso BVS and Radii lists) Atomic Radii: Oxides and Fluorides, Chalcogenides and Halides, and Intermetallics Orbital Radii: Orbital Radii of Atoms and Ions (Waber and Cromer, 1965) Tanabe-Sugano Diagrams: Octahedral Coordination (Java Applet, IMPORTANT software requirements note) Computing TS Diagrams: Stevens Operators I (1952), Stevens Operators II (1953), Point-Charge Models (Hutchings 1964), pyCrystalField Basics of Crystallography, GSAS/EXPGUI, and CMPR (Brian Toby) What R factor is Good Enough? (Toby) 11-BM Information: Capillary Tubes (and Sealing), Helium Cryostat Overview, Sample Absorbance Calculator, TOPAS Parameters Neutron Information: Neutron Scattering Lengths (Neutron News Scattering Lengths (Sears 1992), ADNDT Scattering Lengths (Koester 1991)), Rare Earth Thermal Neutron Resonances (Lynn 1990), Neutron Activation/Absorption Estimator, Inelastic Scattering and Dynamical Susceptibility Radionuclide Data Handbook +2015 X-Ray and Neutron Scattering School Introduction to X-Ray and Neutron Scattering Neutron Generation and Detection Neutron Optics and Instrumentation Synchrotron X-Ray Production and Properties X-Ray Detection X-Ray Optical Components Powder Diffraction (Part 1) Powder Diffraction (Part 2) Neutron Powder Diffraction PDF Analysis Single Crystal Diffraction Diffuse Scattering Engineering Neutron Diffraction High Pressure Scattering Inelastic Neutron Scattering Quasi-Elastic Neutron Scattering Inelastic X-Ray Scattering Magnetic Neutron Scattering Polarized Neutron Scattering Neutron Vibrational Spectroscopy Small Angle Scattering SAXS and SANS Neutron Reflectometry Time-resolved Scattering XMCD X-Ray Absorption Spectroscopy (XAS) XAS Applications in Life Sciences Neutron Imaging X-Ray Microscopy Beamline Proposal Writing Strategies +Diffraction Introduction to X-ray Diffraction Basics of X-ray Powder Diffraction (Speakman) Neutron Scattering Primer Neutron Diffraction as Powerful Materials Tool Multiple Scattering by Neutrons (Sears 1975) Neutron Scattering Phonon Selection Rules (Curratt 1998) Magnetic Scattering by Neutrons (Halpern 1938) Magnetic Structure Determination from Neutron Diffraction X-Ray Resonant Exchange Scattering (Hill and McMorrow) Magnetic Structure Determination from Powder Neutron Diffraction Data (Handouts) Topas6 Tutorial (Redemann 2021, Fun Version) Magnetic Form Factors of 5d Elements and Ions (Ito 2011) Pair Distribution Function Analysis Tutorial (Lujan Center, LANSCE, LANL) Analysis of Local Structure of Alloys via RMC/PDF (Owen 2017) 100 Years of Diffuse Scattering.pdf DyPDF: PDF of Vibrations Lebail (unit cell only) Fitting in GSAS Magnetic Form Factors of 5d Orbitals of Rare Earth Ions (Ito 2012) EXPO 2009 for Powder Structure Solving (Rizzo 2009) Magnetic Form Factor of Diatomic Oxygen (Smirnov 1972) The Charge Flipping Algorithm for solving structures (Oszlanyi and Suto 2008) Simulated Annealing Tutorial (Fry 2014) [Additional Walkthrough (Trump 2016)] Low Background XRD Neutron Powder Fitting in GSAS Magnetic Powder Diffraction Scherrer Size Broadening Strain Broadening Williamson-Hall Analysis Diffraction Analysis of Layer Disorder Line Profile Analysis Warren Line Shapes Converting GSAS-style to FullProf Files Using Laboratory XRD Data in GSAS/EXPGUI (LabXRD.prm, Fry 2013) GSAS II Instrument Files: LT-PXRD_0p6slit.instprm, LT-PXRD_2p0slit.instprm (Trump 2016) SHELXL Tutorial (UCSF) Submitting CIFs to the ICSD +Crystallography IUCr Spacegroup Tables (PDFs: A, A1, B, C, D) Properties of the Thirty Two Point Groups (Koster) [Alternative Version] Crystal Structure Determination (Massa) Crystal Solution Via Mode Analysis: Paper (Stokes 2013), Basis Functions, and Computer-Friendly Tables SARAh: Simulated Annealing and Representation Analysis for Magnetic Structures Statistical Tests on the Crystallographic R-factor (Hamilton 1965) HTML Spacegroup Tables Non-Symmorphic Space Groups Double Antisymmetry Space Groups Bilbao Crystallographic Server ISODISTORT (Stokes, et al. IMPORTANT software requirements note) Wassmaier X-ray Scattering Factors (Improvement on those found in the IUCr Tables) Semi-Emperical Absorption Correction Method By Equivalents (Blessing 1995) Quantification of Local Symmetry (Goodwin 2012) HKL Index Bracket Types Rhombohedral Unit Cell Transforms TEM Diffraction Lengths Crystallographic Point Groups 2-D Polygon Tilings Thermal Shrinkage of Apparant Bond Lengths (Downs 1992) Pseudo-symmetry of Modulated Structures (de Wolff 1974) Bravais Classes for Incommensurate Phases (Janner 1983) Diffuse Scattering from Periodic and Aperiodic Crystals (Frey 1997) Underneath the Bragg Peaks (Egami and Billinge 2003) Reverse Monte Carlo Modelling (McGreevy 2001) Dynamic Radial Distribution Function (McQueeney 1998)

+Statistics Statistical Models (Akaike 1974) Cleaning Up Mysteries: Bayesian Statistics (Jaynes) Calculus Made Easy (Thompson 1914)

+Data Tables and Forms Most Commonly Used Vapor Pressures in Quartz Tubes Ellingham Diagrams: Oxides, Non-Oxides Magnetic Moments of Common Ions Electrochemical Series Brillouin Zones, Special Points (Alternative Conventions), and TRIM momenta (Interactive Viewer) Table of Properties of Over 1500 Common Inorganic Materials (Segerblom) Handbook of Inorganic Chemicals (Patnaik 2003) Atomic Orbital Energy Levels (PDF Version) +Handbooks Carbides (Kosolapova 1971) Gmelins Handbook of Inorganic Chemistry (Gmelin 1974, in German) Structural Chemistry of Layer-Type Phases (Levy 1976) Gmelins Handbook of Inorganic Chemistry (Gmelin 1989) Textbook of Inorganic Chemistry (Wiberg 2007, in German) Handbook of Inorganic Compounds (Perry 2011) Handbook of Inorganic Substances (2013) Chemistry of the Actinide and Transactinide Elements (2006) +Thermodynamic Data Table of Oxide Vapor Pressures (Full Paper) Monatomic Vapors Vapor Pressure of Many Inorganic Compounds Intrinsic Strengh of Fused Silica Thermodynamic Properties of Many Compounds Thermodynamic Properties of Materials (Robie-Waldbaum 1970) JSON List Intermetallic Energy of Formations Thermodynamic Properties of Materials (Navrotsky 1995) Thermodynamic Properties of Many Borides, Silicides, and Sulfates Thermodynamic Properties of Many Halides Thermodynamic Properties of Some Oxides, Halides, Carbides, and Nitrides High Temperature Properties and Thermal Decomposition of Inorganic Salts with Oxyanions (Stern 2001) Thermodynamic Properties of Inorganic Solids Platinum Group Metal Properties Compounds of Rhodium and Iridium Lanthanide and Actinide Chemistry (Cotton 2005) Atlas of Pourbaix Diagrams (Electric Potential vs. pH stability plots) Stability Constants of Metal Ion Complexes (Sillen/Martell 1964) Langes Handbook of Chemistry, including thermoydnamics and solubility products (Speight 1972) A dictionary of chemical solubilities (Messinger) Aqueous Hydroxide Solubility Products Calculating temp-dependent solubility products from thermodynamic data Common Salt Solubility Products Thermodynamic Properties of Aqueous Ions Basic H2O Properties: P-T Autoionization (and vs Ionic Strength; also see TMACl and Notes), Liquid, Steam Thermodynamic Properties of Common Solvents Solubilities in Acetonitrile Solubilities in DMSO Solubilities in DMSO2 (Methylsulfonylmethane) Crown Ether Binding Constants (Chaves 2003) Imidazole and Histimine Metal Binding Affinities (Sjoeberg 1997) EDTA Metal Binding Affinities (Paoletta 1984) Atomic Ionization Energies Elemental Core Shell Binding Energies (EDX, etc) Atomic Polarizabilities X-ray anomalous scattering factors (NIST) X-ray Wavelengths and Atomic Energy Levels pKa's of common chemicals in Acetonitrile: Large 2008 List, Updated 2011 Values Salt Solutions for Relative Humidity Control Tests of Humidity Control with Binary Systems Binary Aqueous Solutions for Relative Humidity Control Absolute Band Energies for Some Semiconductors (Xu, 2000) Martens Handbook of Testing Materials (1899) Martens Materials Science Handbook (1898) Thermal Conductivity of Selected Materials (Liley 1966) Classification of Nickel Steels and Their Basic Properties Lower and Upper Explosive Limits of Various Gases +Printable Sheets and Forms Coarse-ruled Triangular Graph Paper Fine-ruled Triangular Graph Paper

+General Laboratory Information Laboratory Safety Laboratory Waste Disposal Avaya 2410 Phone Manual Bloomberg Visitor Parking Pass (Directions); Reserve online First! Homewood Campus Map Proper care of pellet press dies

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