Abstract
According to the definition given by the International Union of Crystallographers, “by “crystal” is meant any solid having an essentially discrete diffraction diagram” [1]. A typical diffraction pattern corresponding to a “classical” periodic, perfect crystal looks like the one shown in Fig. 2.1 [2]. This pattern corresponds to the inner structure of the material, which can be represented as an array of periodically repeating fragments. The whole structure can be described by defining the repeating fragment (basis) and a set of three non-coplanar unit vectors. The three unit vectors can be used to build a parallelepiped: a unit cell. Translations are not the only symmetry elements that can be used to describe a periodic structure. Combinations of mirror reflections, rotations, inversions, glides and screw rotations form groups, that are termed space symmetry groups. [3] A periodic structure can then be described only by defining the crystallographic coordinates of an asymmetric unit and the symmetry operations of the space symmetry group.
This is a preview of subscription content, log in via an institution.
Buying options
Tax calculation will be finalised at checkout
Purchases are for personal use only
Learn about institutional subscriptionsNotes
- 1.
Crystallographic coordinates are defined in the coordination system related to the three primitive translation vectors.
References
Janssen T, Janner A, Looijenga-Vos A, de Wolff PM (2006) Incommensurate and commensurate modulated structures. Int Tables Crystallogr C:907–955. https://doi.org/10.1107/97809553602060000624
Wagner T, Schoenleber A (2009) A non-mathematical introduction to the superspace description of modulated structures. Acta Crystallogr B 65(3):249–268. https://doi.org/10.1107/S0108768109015614
Souvignier B, Wondratschek H, Aroyo MI, Chapuis G, Glazer AM (2016) Space groups and their descriptions. Int Tables Crystallogr A:42–74. https://doi.org/10.1107/97809553602060000922
Smaalen SV (2007) Incommensurate crystallography. Oxford University Press, New York
Arakcheeva A, Bykov M, Bykova E, Dubrovinsky L, Pattison P, Dmitriev V, Chapuis G (2017) Incommensurate atomic density waves in the high-pressure IVb phase of barium. IUCrJ 4(2):152–157. https://doi.org/10.1107/S2052252517000264
Shechtman D, Blech I, Gratias D, Cahn JW (1984) Metallic phase with long-range orientational order and no translational symmetry. Phys Rev Lett 53(20):1951–1953. https://doi.org/10.1103/PhysRevLett.53.1951
Levine D, Steinhardt PJ (1984) Quasicrystals: a new class of ordered structures. Phys Rev Lett 53(26):2477–2480. https://doi.org/10.1103/PhysRevLett.53.2477
Zong X, Ungar G, Liu Y, Percec V, Dulcey E, Hobbs JK (2004) Supramolecular dendritic liquid quasicrystals. Nature 428(11):157–160. https://doi.org/10.1038/nature02368
Hayashida K, Dotera T, Takano A, Matsushita Y (2007) Polymeric quasicrystal: mesoscopic quasicrystalline tilling in ABC star polymers. PRL 98:195502-1–195502-4. https://doi.org/10.1103/PhysRevLett.98.195502
Ivanov EY, Konstanchuk IG, Bokhonov BD, Boldyrev VV (1989) Mechanochemical synthesis of icosahedral phases in Mg-Zn-Al and Mg-Cu-Al alloys. React Solids 7(2):167–172. https://doi.org/10.1016/0168-7336(89)80026-9
Bokhonov B, Konstanchuk I, Ivanov E, Boldyrev V (1992) Stage formation of quasi-crystals during mechanical treatment of the cubic Frank-Kasper phase Mg32(Zn, Al)49. J Alloys Compd 187(1):207–214. https://doi.org/10.1016/0925-8388(92)90534-G
Janot C (1992) Quasicrystals A. Primer. Monographs on the physics and chemistry of materials. Oxford University Press, Oxford
Bokhonov B, Konstanchuk I, Boldyrev V, Ivanov E (1993) HRTEM study of milling induced phase transition and quasicrystalline formation in Mg32(Al, Zn)49 cubic Frank-Kasper phase. J Non Cryst Solids 153:606–610. https://doi.org/10.1016/0022-3093(93)90424-V
Twarock R (2004) A tiling approach to virus capsid assembly explaining a structural puzzle in virology. J Theor Biol 226(4):477–482. https://doi.org/10.1016/j.jtbi.2003.10.006
Bokhonov BB (2008) Mechanical alloying and self-propagating high-temperature synthesis of stable icosahedral quasicrystals. J Alloys Compd 461(1):150–153. https://doi.org/10.1016/j.jallcom.2007.07.015
Steurer W, Deloudi S (2008) Fascinating quasicrystals. Acta Cryst A 64(1):1–11. https://doi.org/10.1107/S0108767307038627
Jaric M (2012) Introduction to quasicrystals. Elsevier, Burlington
Kobeko PP (1952) Amorphous compounds. USSR Academy of Sciences Publishing House, Moscow
Porai-Koshits EA (1958) The possibilities and results of x-ray methods for investigation of glassy substances. In: Lebedev AA (ed) The structure of glass. Consultants Bureau, New York, pp 25–35
Greaves GN, Sen S (2007) Inorganic glasses, glass-forming liquids and amorphising solids. Adv Phys 56(1):1–166. https://doi.org/10.1080/00018730601147426
Henderson GS (2005) The structure of silicate melts: a glass perspective. Can Miner 43(6):1921–1958. https://doi.org/10.2113/gscanmin.43.6.1921
Descamps M (ed) (2016) Disordered pharmaceutical materials. Wiley, Weinheim
Hancock BC, Shalaev EY, Shamblin SL (2002) Polyamorphism: a pharmaceutical science perspective. J Pharm Pharmacol 54(8):1151–1152. https://doi.org/10.1211/002235702320266343
Shalaev E, Wu K, Shamblin S, Krzyzaniak JF, Descamps M (2016) Crystalline mesophases: structure, mobility, and pharmaceutical properties. Adv Drug Deliv Rev 100:194–211. https://doi.org/10.1016/j.addr.2016.04.002
Bates S, Zografi G, Engers D, Morris K, Crowley K, Newman A (2006) Analysis of amorphous and nanocrystalline solids from their x-ray diffraction patterns. Pharm Res 23(10):2333–2349. https://doi.org/10.1107/s11095-006-9086-2
Doi K (1976) Profile analysis of amorphous haloes by means of a Fourier transformation, with special reference to the structures of amorphous Pt-C and Ni-P. J Appl Cryst 9:382–390. https://doi.org/10.1107/S0021889876011679
Stetsko YP, Shanahan N, Deford H, Zayed A (2017) Quantification of supplementary cementitious content in blended Portland cement using an iterative Rietveld–PONKCS technique. J Appl Cryst 50:498–507. https://doi.org/10.1107/S1600576717002965
Bergese P, Colombo I, Gervasoni D, Depero LE (2003) Assessment of the x-ray diffraction-absorption method for quantitative analysis of largely amorphous pharmaceutical composites. J Appl Cryst 36:74–79. https://doi.org/10.1107/S002188980201926X
Proffen T, Neder RB (2012) Analysis of complex materials through the application and analysis of the pair distribution function (PDF). Z Kristallogr Cryst Mater 227(5). https://doi.org/10.1524/zkri.2012.0002
Wright AC, Hulme RA, Grimley D, Sinclair RN, Martin SW, Price DL, Galeener FL (1991) The structure of some simple amorphous network solids revisited. J Non Cryst Solids 129:213–232. https://doi.org/10.1016/0022-3093(91)90098-Q
Yarnell J, Katz M, Wenzel R, Koenig S (1973) Structure factor and radial distribution function for liquid argon at 85°K. Phys Rev A 7(6):2130–2144. https://doi.org/10.1103/PhysRevA.7.2130
Gingrich NS, Heaton L (1961) Structure of alkali metals in the liquid state. J Chem Phys 34(3):873–878. https://doi.org/10.1063/1.1731688
Sirota E, Ou-Yang H, Sinha S, Chaikin P, Axe J, Fujii Y (1989) Complete phase diagram of a charged colloidal system: a synchrotron X-ray scattering study. Phys Rev Lett 62(13):1524–1527. https://doi.org/10.1103/PhysRevLett.62.1524
Pedersen JS (1997) Analysis of small-angle scattering data from colloids and polymer solutions: modeling and least-squares fitting. Adv Colloid Interface Sci 70:171–210. https://doi.org/10.1016/S0001-8686(97)00312-6
Toby BH, Egami T (1992) Accuracy of pair distribution function analysis applied to crystalline and non-crystalline materials. Acta Cryst A 48:336–346. https://doi.org/10.1107/S0108767391011327
Prill D, Juhás P, Billinge SJL, Schmidt MU (2016) Towards solution and refinement of organic crystal structures by fitting to the atomic pair distribution function. Acta Cryst A 72:62–72. https://doi.org/10.1107/S2053273315022457
Granlund L, Billinge SJL, Duxbury PM (2015) Algorithm for systematic peak extraction from atomic pair distribution functions. Acta Cryst A 71:392–409. https://doi.org/10.1107/S2053273315005276
Chapman KW, Lapidus SH, Chupas PJ (2015) Applications of principal component analysis to pair distribution function data. J Appl Cryst 48:1619–1626. https://doi.org/10.1107/S1600576715016532
Prill D, Juhás P, Schmidt MU, Billinge SJL (2015) Modelling pair distribution functions (PDFs) of organic compounds: describing both intra- and intermolecular correlation functions in calculated PDFs. J Appl Cryst 48:171–178. https://doi.org/10.1107/S1600576714026454
Peterson PF, Bozin ES, Proffen T, Billinge SJL (2003) Improved measures of quality for the atomic pair distribution function. J Appl Cryst 36:53–64. https://doi.org/10.1107/S0021889802018708
Mu X, Neelamraju S, Sigle W, Koch CT, Totò N, Schön JC, Bach A, Fischer D, Jansen M, van Aken PA (2013) Evolution of order in amorphous-to-crystalline phase transformation of MgF2. J Appl Cryst 46:1105–1116. https://doi.org/10.1107/S0021889813011345
Tran DT, Svensson G, Tai CW (2017) SUePDF: a program to obtain quantitative pair distribution functions from electron diffraction data. J Appl Cryst 50:304–312. https://doi.org/10.1107/S160057671601863X
Masson O, Thomas P (2013) Exact and explicit expression of the atomic pair distribution function as obtained from x-ray total scattering experiments. J Appl Cryst 46:461–465. https://doi.org/10.1107/S0021889812051357
Crocker JC, Grier DG (1996) Methods of digital video microscopy for colloidal studies. J Colloid Interface Sci 179:298–310. https://doi.org/10.1006/jcis.1996.0217
Nakroshis P, Amoroso M, Legere J, Smith C (2003) Measuring Boltzmann’s constant using video microscopy of Brownian motion. Am J Phys 71(6):568–573. https://doi.org/10.1119/1.1542619
Gasser U, Weeks ER, Schofield A, Pusey PN, Weitz DA (2001) Real-space imaging of nucleation and growth in colloidal crystallization. Science 292(5515):258–262. http://www.jstor.org/stable/3082728
Weeks ER, Crocker JC, Levitt AC, Schofield A, Weitz DA (2000) Three-dimensional direct imaging of structural relaxation near the colloidal glass transition. Science 287(5453):627–631. http://www.sciencemag.org
Cipelletti L, Manley S, Ball RC, Weitz DA (2000) Universal aging features in the restructuring of fractal colloidal gels. Phys Rev Lett 84(10):2275–2278. https://doi.org/10.1103/PhysRevLett.84.2275
Varadan P, Solomon MJ (2003) Direct visualization of long-range heterogeneous structure in dense colloidal gels. Langmuir 19(3):509–512. https://doi.org/10.1021/la026303jCCC
Peterson J, TenCate J, Proffen T, Darling T, Nakotte H, Page K (2013) Quantifying amorphous and crystalline phase content with the atomic pair distribution function. J Appl Cryst 46:332–336. https://doi.org/10.1107/S0021889812050595
Martin AV (2017) Orientational order of liquids and glasses via fluctuation diffraction. IUCrJ 4(1):24–36. https://doi.org/10.1107/S2052252516016730
Zobel M (2016) Observing structural reorientations at solvent-nanoparticle interfaces by x-ray diffraction – putting water in the spotlight. Acta Cryst A72:621–631. http://doi.org.ololo.sci-hub.bz/10.1107/S2053273316013516
Salmon PS (1994) Real space manifestation of the first sharp diffraction peak in the structure factor of liquid and glassy materials. Proc R Soc Lond A 445(1924):351–365. http://www.jstor.org/stable/52602
Elliott SR (1991) Origin of the first sharp diffraction peak in the structure factor of covalent glasses. Phys Rev Lett 67:711. https://doi.org/10.1103/PhysRevLett.67.711
Elliott SR (1995) Extended-range order, interstitial voids and the first sharp diffraction peak of network glasses. J Non Cryst Solids 182(1–2):40–48. https://doi.org/10.1016/0022-3093(94)00539-7
Inamura Y, Arai M, Nakamura M, Otomo T, Kitamura N, Bennington SM, Hannon AC, Buchenau U (2001) Intermediate range structure and low-energy dynamics of densified vitreous silica. J Non Cryst Solids 283–295:389–393. https://doi.org/10.1016/S0022-3093(01)00824-9
Voronoi G (1908) Nouvelles applications des paramètres continus à la théorie des formes quadratiques. J die Reine und Angew Mathematik 133(133):97–178. https://doi.org/10.1515/crll.1908.134.198
Brumberger H, Goodisman J (1983) Voronoi cells: an interesting and potentially useful cell model for interpreting the small-angle scattering of catalysts. J Appl Cryst 16:83–88. https://doi.org/10.1107/S002188988300998X
Bernal JD (1960) Geometry of the structure of monatomic liquids. Nature 185(4706):68–70. https://doi.org/10.1038/185068a0
Bernal JD, Mason J, Knight KR (1962) Radial distribution of the random close packing of equal spheres. Nature 194(4832):957–958. https://doi.org/10.1038/194957a0
Finney JL, Woodcock LV (2014) Renaissance of Bernal’s random close packing and hypercritical line in the theory of liquids. J Phys Condens Matter 26(46):463102(19pp). https://doi.org/10.1088/0953-8984/26/46/463102
Li F, Liu XJ, Lu ZP (2014) Atomic structural evolution during glass formation of a Cu–Zr binary metallic glass. Comput Mater Sci 85:147–153. https://doi.org/10.1016/j.commatsci.2013.12.058
Salmon PS, Martin RA, Mason PE, Cuello GJ (2005) Topological versus chemical ordering in network glasses at intermediate and extended length scales. Nature 435(5):75–78. http://www.nature.com/nature
Greaves GN, Ngai KL (1995) Reconciling ionic-transport properties with atomic structure in oxide glasses. Phys Rev B52(9):6358–6380. https://doi.org/10.1103/PhysRevB.52.6358
Zachariasen WH (1932) The atomic arrangement in glass. J Am Chem Soc 54(10):3841–3851. https://doi.org/10.1021/ja01349a006
Greaves GN (1985) EXAFS and the structure of glass. J Non Cryst Solids 71(1–3):203–217. https://doi.org/10.1016/0022-3093(85)90289-3
Franzblau DS (1991) Computation of ring statistics for network models of solids. Phys Rev B 44(10):4925–4930. https://doi.org/10.1103/PhysRevB.44.4925
Gladden LF (1990) Medium-range order in v-SiO2. J Non Cryst Solids 119(3):318–330. https://doi.org/10.1016/0022-3093(90)90305-6
Balducci R, Pearlman RS (1994) Efficient exact solution of the ring perception problem. J Chem Inf Comput Sci 34(4):822–831. http://pubs.acs.org/doi/abs/10.1021/ci00020a016?journalCode=jcics1
Yuan X, Cormack AN (1997) MD simulated structures of soda-lime-silica glass and its surface. Ceram Trans 82:281–286
Angell CA, Kanno H (1976) Density maxima in high-pressure supercooled water and liquid silicon dioxide. Science 193(4258):1121–1122. https://doi.org/10.1126/science.193.4258.1121
Sen S, Andrus RL, Baker DE, Murtagh MT (2004) Observation of an anomalous density minimum in vitreous silica. Phys Rev Lett 93(12):125902-1–125902-4. https://doi.org/10.1103/PhysRevLett.93.125902
Angell CA (1995) Formation of glasses from liquids and biopolymers. Science 267(5206):1924–1935. https://doi.org/10.1126/science.267.5206.1924
Andronis V, Zografi G (2000) Crystal nucleation and growth of indomethacin polymorphs from the amorphous state. J Non Cryst Solids 271(3):236–248. https://doi.org/10.1016/S0022-3093(00)00107-1
Politov AA, Kostrovskii VG, Boldyrev VV (2001) Conditions of preparation and crystallization of amorphous paracetamol. Russ J Phys Chem A 75(11):1903–1911. http://cat.inist.fr/?aModele=afficheN&cpsidt=13620211
Taylor LS, Zografi G (1997) Spectroscopic characterization of interactions between PVP and indomethacin in amorphous molecular dispersions. Pharm Res 14(12):1691–1698. https://doi.org/10.1023/A:1012167410376
Andronis V, Zografi G (1997) Molecular mobility of supercooled amorphous indomethacin, determined by dynamic mechanical analysis. Pharm Res 14(4):410–414. https://doi.org/10.1023/A:1012026911459
Turnbull D (1976) Relation of crystallization behavior to structure in amorphous systems. Ann NY Acad Sci 279:185. https://doi.org/10.1111/j.1749-6632.1976.tb39706.x
Demirjian BG, Dosseh G, Chauty A, Ferrer ML, Morineau D, Lawrence C, Takeda K, Kivelson D, Brown S (2001) Metastable solid phase at the crystalline amorphous border: the glacial phase of triphenyl phosphite. J Phys Chem B 105:2107–2116. https://doi.org/10.1021/jp000765t
Schmidt H (1989) Organic modification of glass structure. New glasses or new polymers? J Non Cryst Solids 12:419–423. https://doi.org/10.1016/0022-3093(89)90565-6
Mishima O, Calvert LD, Whalley E (1984) Melting ice’ I at 77 K and 10 kbar: a new method of making amorphous solids. Nature 310:393–395. https://doi.org/10.1038/310393a0
Grimsditch M (1984) Polymorhism in amorphous SiO2. Phys Rev Lett 52:2379–2381
Mitius AC, Patashinskii AZ, Shimilo BI (1985) The liquid-liquid phase transition. Phys Lett A 113:41–44. https://doi.org/10.1016/0375-9601(85)90602-4
Thiel MV, Ree FH (1993) High-pressure liquid-liquid phase change in carbon. Phys Rev B 48(6):3591–3599. https://doi.org/10.1103/PhysRevB.48.3591
Riebling EF (1970) Relationships between phase diagrams and the structure of glass-forming oxide melts. Phase diagrams. Materials science and technology, vol III. Academic, New York, pp 253–270. https://doi.org/10.1016/B978-0-12-053203-2.50015-6
Tsukumi I, Yamamuro O, Suga H (1994) Heat capacities and glass transitions of ground amorphous solid and liquid-quenched glass of tri-O-methyl-ß-cyclodextrin. J Non Cryst Solids 175:187–194. https://doi.org/10.1016/0022-3093(94)90010-8
Aasland S, McMillan PF (1994) Density-driven liquid-liquid phase separation in the system Al2O3-Y2O3. Nature 369:633–636. https://doi.org/10.1038/369633a0
Flory PJ (1973) Macromolecular chemistry-8. International symposium macromolecules held in Helsinki, Molecular configuration in bulk polymers, Finland, pp 1–15, 2–7 July 1972. https://doi.org/10.1016/B978-0-408-70516-5.50004-0
Franzese G, Malescio G, Skibinsky A, Buldyrev SV, Stanley HE (2001) Generic mechanism for generating a liquid-liquid phase transition. Nature 409(6821):692–695. https://doi.org/10.1038/35055514
Boyer RF (1976) General reflections on the symposium on physical structure of the amorphous state. J Macromol Sci Phys B 12(2):253–301. https://doi.org/10.1080/00222347608212774
Ishii K, Nakayama H, Koyama K, Yokoyama Y, Ohashi Y (1997) Molecular conformation of butanenitrile in gas, liquid, glass, and crystalline states: in relation to the stability of the glass state. Bull Chem Soc Jpn 70(9):2085–2091. https://doi.org/10.1246/bcsj.70.2085
Jarmelo S, Maria TMR, Leitao MLP, Fausto R (2001) The low temperature crystalline and glassy states of methyl α-hydroxy-isobutyrate. Phys Chem Chem Phys 3:387–392. https://doi.org/10.1039/B007722O
Ganguli D (2009) Polyamorphism in liquids and amorphous substances: an analogue of polymorphism in crystalline solids. Trans Indian Ceram Soc 68(2):65–80. https://doi.org/10.1080/0371750X.2009.11082161
Mishima O, Calvert LD, Whalley E (1985) An apparently first-order transition between two amorphous phases of ice induced by pressure. Nature 314(6006):76–78. https://doi.org/10.1038/314076a0
Poole PH, Grande T, Angell CA, McMillan PF (1997) Polymorphic phase transitions in liquids and glasses. Science 275(5298):322–323. https://doi.org/10.1126/science.275.5298.322
Poole PH, Sciortino F, Essmann U, Stanley HE (1992) Phase behaviour of metastable water. Nature 360(6402):324–328. https://doi.org/10.1038/360324a0
Debenedetti PG (2003) Supercooled and glassy water. J Phys Condens Matter 15(45):R1669–R1726. https://doi.org/10.1088/0953-8984/15/45/R01
Sciortino F, Essmann U, Stanley HE, Hemmati M, Shao J, Wolf GH, Angell CA (1995) Crystal stability limits at positive and negative pressures, and crystal-to-glass transitions. Phys Rev E 52(6):6484–6491. https://doi.org/10.1103/PhysRevE.52.6484
Rapoport E (1967) Model for melting-curve maxima at high pressure. J Chem Phys 46(8):2891–2896. https://doi.org/10.1063/1.1841150
Rapoport E (1967) Melting-curve maxima at high pressure. II. Liquid cesium. Resistivity, Hall Effect, and composition of molten tellurium. J Chem Phys 48(4):1433–1438. https://doi.org/10.1063/1.1668858
Sastry S, Debenedetti PG, Sciortino F, Stanley HE (1996) Singularity-free interpretation of the thermodynamics of supercooled water. Phys Rev E 53(6):6144–6154. https://doi.org/10.1103/PhysRevE.53.6144
Deb SK, Wilding M, Somayazulu M, McMillan PF (2001) Pressure-induced amorphization and an amorphous–amorphous transition in densified porous silicon. Nature 414(6863):528–530. https://doi.org/10.1038/35107036
Monahan AR, Kuder JE (1972) Spectroscopic differences between crystalline and amorphous phases of indigo. J Org Chem 37(25):4182–4184. https://doi.org/10.1021/jo00798a048
Hédoux A, Paccou L, Guinet Y, Willart JF, Descamps M (2009) Using the low-frequency Raman spectroscopy to analyze the crystallization of amorphous indomethacin. Eur J Pharm Sci 38(2):156–164. https://doi.org/10.1016/j.ejps.2009.06.007
Wang B, Pikal MJ (2010) The impact of thermal treatment on the stability of freeze dried amorphous pharmaceuticals: I. Dimer formation in sodium ethacrynate. J Pharm Sci 99(2):663–682. https://doi.org/10.1002/jps.21959
Sastry S, Angell CA (2003) Liquid–liquid phase transition in supercooled silicon. Nat Mater 2(11):739–743. https://doi.org/10.1038/nmat994
Hedler A, Klaumunzer SL, Wesch W (2004) Amorphous silicon exhibits a glass transition. Nat Mater 3(11):804–809. https://doi.org/10.1038/nmat1241
McMillan PF (2000) Phase transitions: Jumping between liquid states. Nature 403(6667):151–152. https://doi.org/10.1038/35003088
Wilding MC, McMillan PF (2001) Polyamorphic transitions in yttria–alumina liquids. J Non Cryst Solids 293–295:357–365. https://doi.org/10.1016/S0022-3093(01)00686-X
Wilding MC, Wilson M, McMillan PF (2005) X–ray and neutron diffraction studies and MD simulation of atomic configurations in polyamorphic Y2O3-Al2O3 systems. Proc R Soc London, Ser A 363:589–607. https://doi.org/10.1098/rsta.2004.1510
Katayama Y, Mizutani T, Utsumi W, Shimomura O, Yamkata M, Funakoshi K-I (2000) A first-order liquid–liquid phase transition in phosphorus. Nature 403(6766):170–173. https://doi.org/10.1038/35003143
Senda Y, Shimojo F, Hoshimo K (2002) The liquid–liquid phase transition of liquid phosphorus studied by ab initio molecular-dynamics simulations. J Non Cryst Solids 312–314:80–84. https://doi.org/10.1016/S0022-3093(02)01653-8
Katayama Y, Inamura Y, Mizutani T, Yamakata M, Utsumi W, Shimomura O (2004) Macroscopic separation of dense fluid phase and liquid phase of phosphorus. Science 306(5697):848–851. https://doi.org/10.1126/science.1102735
Brazhkin VV, Popova SV, Voloshin RN (1999) Pressure–temperature phase diagram of molten elements: selenium, sulfur and iodine. Phys B Condens Matter 265(1–4):64–71. https://doi.org/10.1016/S0921-4526(98)01318-0
Monaco G, Falconi S, Crichton WA, Mezouar M (2003) Nature of the first-order phase transition in fluid phosphorus at high temperature and pressure. Phys Rev Lett 90(25):255701. https://doi.org/10.1103/PhysRevLett.90.255701
Tsybulya SV, Kryukova GN (2008) Nanocrystalline transition aluminas: nanostructure and features of x-ray powder diffraction patterns of low-temperature Al2O3 polymorphs. Phys Rev B 77(2):024112. https://doi.org/10.1103/PhysRevB.77.024112
Isupova LA, Alikina GM, Tsybulya SV, Boldyreva NN, Kryukova GN, Yakovleva IS, Isupov VP, Sadykov VA (2001) Real structure and catalytic activity of La1−xSrxCoO3 perovskites. Int J Inorg Mater 3(6):559–562. https://doi.org/10.1016/S1466-6049(01)00062-9
Nikulina O, Yatsenko D, Bulavchenko O, Zenkovets G, Tsybulya S (2016) Debye function analysis of nanocrystalline gallium oxide γ-Ga2O3. Z Kristallogr Cryst Mater 231(5):261–266. https://doi.org/10.1515/zkri-2015-1895
Kryukova GN, Klenov DO, Ivanova AS, Tsybulya SV (2000) Vacancy ordering in the structure of γ-Al2O3. J Eur Ceram Soc 20(8):1187–1189. https://doi.org/10.1016/S0955-2219(99)00278-2
Cherepanova SV, Tsybulya SV (2000) Simulation of X-ray powder diffraction patterns for low-ordered materials. J Mol Catal A Chem 158(1):263–266. https://doi.org/10.1016/S1381-1169(00)00087-X
Sadykov VA, Isupova LA, Tsybulya SV, Cherepanova SV, Litvak GS, Burgina EB, Kustova GN, Kolomiichuk VN, Ivanov VP, Paukshtis EA, Golovin AV, Avvakumov EG (1996) Effect of mechanical activation on the real structure and reactivity of iron (III) oxide with corundum-type structure. J Solid State Chem 123(2):191–202. https://doi.org/10.1006/jssc.1996.0168
Isupova LA, Sadykov VA, Tsybulya SV, Kryukova GN, Ivanov VP, Petrov AN, Kononchuk OF (1997) Effect of structural disorder on the catalytic activity of mixed La−Sr−Co−Fr−O perovskites. React Kinet Catal Lett 62(1):129–135. https://doi.org/10.1007/BF02475723
Cherepanova SV, Tsybulya SV (2004) Simulation of X-ray powder diffraction patterns for one-dimensionally disordered crystals. Mater Sci Forum 443:87–90. https://doi.org/10.4028/www.scientific.net/MSF.443-444.87
Cherepanova SV, Tsybulya SV (2006) Influence of coherent connection of crystalline blocks on the diffraction pattern of nanostructured materials. Z Kristallogr Suppl 23:155–160. https://doi.org/10.1524/zksu.2006.suppl_23.155
Kryukova GN, Tsybulya SV, Solovyeva LP, Sadykov VA, Litvak GS, Andrianova MP (1991) Effect of heat treatment on microstructure evolution of haematite derived from synthetic goethite. Mater Sci Eng A 149(1):121–127. https://doi.org/10.1016/0921-5093(91)90793-M
Wunderlich B (1999) A classification of molecules, phases, and transitions as recognized by thermal analysis. Thermochim Acta 340–341:37–52. https://doi.org/10.1016/S0040-6031(99)00252-X
Levine H, Shalaev E, Zografi G (2002) The concept of ‘structure’ in amorphous solids from the perspective of the pharmaceutical sxciences. In: Levine H (ed) Amorphous food and pharmaceutical systems. Royal Society of Chemistry, Cambridge, pp 11–30. https://doi.org/10.1039/9781847550118-00011
Cui Y (2007) A material science perspective of pharmaceutical solids. Int J Pharm 339:3–18. https://doi.org/10.1016/j.ijpharm.2007.04.021
Seyer JJ, Luner PE, Kemper MS (2000) Application of diffuse reflectance near-infrared spectroscopy for determination of crystallinity. J Pharm Sci 89(10):1305–1316. https://doi.org/10.1002/1520-6017(200010)89:10<1305::AID-JPS8>3.0.CO;2-Q
Bernhard W, Wei C (1996) The difference between liquid crystals and conformationally disordered crystals. In: Isayev AI, Kyu T, Cheng SZD (eds) Liquid-crystalline polymer systems. ACS symposium series, vol 632. American Chemical Society, Washington, DC, pp 232–248. https://doi.org/10.1021/bk-1996-0632.ch015
Singh S (2002) Liquid crystals: fundamentals. World Scientific, Singapore
Kumar S (2001) Liquid crystals: experimental study of physical properties and phase transitions. Cambridge University Press, Cambridge
Sherwood JN (ed) (1978) The plastically crystalline state. Wiley, Hoboken, NJ
Billinge SJL, Thorpe MF (eds) (1998) Local structure from diffraction. Springer, New York. 399 p
Author information
Authors and Affiliations
Rights and permissions
Copyright information
© 2018 Springer International Publishing AG
About this chapter
Cite this chapter
Rams-Baron, M., Jachowicz, R., Boldyreva, E., Zhou, D., Jamroz, W., Paluch, M. (2018). Order vs. Disorder in the Solid State. In: Amorphous Drugs. Springer, Cham. https://doi.org/10.1007/978-3-319-72002-9_2
Download citation
DOI: https://doi.org/10.1007/978-3-319-72002-9_2
Published:
Publisher Name: Springer, Cham
Print ISBN: 978-3-319-72001-2
Online ISBN: 978-3-319-72002-9
eBook Packages: Chemistry and Materials ScienceChemistry and Material Science (R0)