Academic literature on the topic 'Crystal engineering principles'
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Journal articles on the topic "Crystal engineering principles"
Dandela, Rambabu. "Crystal engineering principles: fluoroquinolone salts." Acta Crystallographica Section A Foundations and Advances 73, a2 (December 1, 2017): C413. http://dx.doi.org/10.1107/s2053273317091604.
Full textMontoya, Francisco G., Raúl Baños, Alfredo Alcayde, and Francisco Manzano-Agugliaro. "Symmetry in Engineering Sciences II." Symmetry 12, no. 7 (July 1, 2020): 1077. http://dx.doi.org/10.3390/sym12071077.
Full textSharara, Kudzaishe N., Kudzanai Nyamayaro, Merrill M. Wicht, Gerhard A. Venter, and Nikoletta B. Báthori. "Multicomponent crystals of nitrofurazone – when more is less." CrystEngComm 21, no. 7 (2019): 1091–96. http://dx.doi.org/10.1039/c8ce01911h.
Full textYu, Rui, Naibo Lin, Weidong Yu, and Xiang Yang Liu. "Crystal networks in supramolecular gels: formation kinetics and mesoscopic engineering principles." CrystEngComm 17, no. 42 (2015): 7986–8010. http://dx.doi.org/10.1039/c5ce00854a.
Full textWang, Haonan, Tianhua Xu, Yaoxin Fu, Ziyihui Wang, Mark S. Leeson, Junfeng Jiang, and Tiegen Liu. "Liquid Crystal Biosensors: Principles, Structure and Applications." Biosensors 12, no. 8 (August 14, 2022): 639. http://dx.doi.org/10.3390/bios12080639.
Full textMatko, Vojko, and Miro Milanovič. "Detection Principles of Temperature Compensated Oscillators with Reactance Influence on Piezoelectric Resonator." Sensors 20, no. 3 (February 1, 2020): 802. http://dx.doi.org/10.3390/s20030802.
Full textJia, Fanhao, Yuting Qi, Shunbo Hu, Tao Hu, Musen Li, Guodong Zhao, Jihua Zhang, Alessandro Stroppa, and Wei Ren. "Structural properties and strain engineering of a BeB2 monolayer from first-principles." RSC Advances 7, no. 61 (2017): 38410–14. http://dx.doi.org/10.1039/c7ra07137j.
Full textManoj, K., Rui Tamura, Hiroki Takahashi, and Hirohito Tsue. "Crystal engineering of homochiral molecular organization of naproxen in cocrystals and their thermal phase transformation studies." CrystEngComm 16, no. 26 (2014): 5811–19. http://dx.doi.org/10.1039/c3ce42415d.
Full textMukherjee, Soumya, Debobroto Sensharma, Kai-Jie Chen, and Michael J. Zaworotko. "Crystal engineering of porous coordination networks to enable separation of C2 hydrocarbons." Chemical Communications 56, no. 72 (2020): 10419–41. http://dx.doi.org/10.1039/d0cc04645k.
Full textLaude, V. "Principles and properties of phononic crystal waveguides." APL Materials 9, no. 8 (August 1, 2021): 080701. http://dx.doi.org/10.1063/5.0059035.
Full textDissertations / Theses on the topic "Crystal engineering principles"
Salvetti, Matteo Francesco. "Hyperelastic continuum modeling of cubic crystals based on first-principles calculations." Thesis, Massachusetts Institute of Technology, 2010. http://hdl.handle.net/1721.1/62517.
Full textCataloged from PDF version of thesis.
Includes bibliographical references (p. 363-381).
We propose new constitutive equations that capture the low-temperature hyperelastic response of cubic-symmetry single crystals up to large volumetric and deviatoric deformations in the region of stability of the equilibrium crystal phase. For the first time, we combine the formalism of continuum mechanics invariant theory with the predictive capability of quantum mechanics to model the hyperelastic response of cubic crystals. We use a complete and irreducible basis of strain invariants to capture the symmetries and non-linearities of the crystal and quantum mechanics calculations to access all the required materials properties. The approach builds on mathematical theories originally developed in the 70s and 80s by Boehler, Spencer, Zheng and Betten, among others, and on the use of quantum mechanics, as implemented in Density Functional Theory (DFT), to solve the governing Schrödinger equations. The proposed constitutive equations enable a unique understanding and an accurate prediction of local elastic fields in cubic-crystals, using a fully general continuum approach, under extreme conditions that are of current scientific interest: response to shock-waves, nano-indentation and loading of ultra-strength materials. We report excellent results obtained in the prediction of the hyperelastic response of aluminum, C-diamond and silicon single-crystals. In particular, for the class of problems pertaining to defect-free single crystals, our approach allows the characterization of the continuum non-linear response of the crystal without the construction of empirical 4 atomic potentials. We discuss the accuracy expected in the prediction of crystal elastic constants using DFT. We highlight the outstanding results obtained for elements such as aluminum, C-diamond and silicon and the still unresolved difficulties in the prediction of the shearing elastic constant C44 of early transition metals such as niobium and vanadium. Finally, we discuss the use of DFT methods to predict crystal properties based on electron-phonon coupling, such as the superconducting critical temperature Tc.
by Matteo Francesco Salvetti.
Ph.D.
Delandar, Arash Hosseinzadeh. "Modeling defect structure evolution in spent nuclear fuel container materials." Doctoral thesis, KTH, Materialteknologi, 2017. http://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-206175.
Full textQC 20170428
Hirst, Evan. "Acoustic wave and bond rupture based biosensor-- principle and development : a thesis presented in partial fulfilment of the requirements for the degree of Doctor of Philosophy at Massey University, Palmerston North, New Zealand." 2009. http://hdl.handle.net/10179/1291.
Full textBooks on the topic "Crystal engineering principles"
Principles of solidification: An introduction to modern casting and crystal growth concepts. New York: Springer Verlag, 2011.
Find full textQuantum chemistry of solids: The LCAO first principles treatment of crystals. Berlin: Springer, 2007.
Find full textPrinciples of plant genetics and breeding. 2nd ed. Hoboken, NJ: Wiley, 2012.
Find full textLecoq, Paul, Alexander Gektin, and Mikhail Korzhik. Inorganic Scintillators for Detector Systems: Physical Principles and Crystal Engineering. Springer, 2016.
Find full textLecoq, Paul, Alexander Gektin, and Mikhail Korzhik. Inorganic Scintillators for Detector Systems: Physical Principles and Crystal Engineering. Springer, 2018.
Find full textLecoq, Paul, Alexander Annenkov, Alexander Gektin, Mikhail Korzhik, and Christian Pedrini. Inorganic Scintillators for Detector Systems: Physical Principles and Crystal Engineering (Particle Acceleration and Detection). Springer, 2006.
Find full textNewnham, Robert E. Properties of Materials. Oxford University Press, 2004. http://dx.doi.org/10.1093/oso/9780198520757.001.0001.
Full textKrishnan, Kannan M. Principles of Materials Characterization and Metrology. Oxford University Press, 2021. http://dx.doi.org/10.1093/oso/9780198830252.001.0001.
Full textMcLeish, Tom. Soft Matter: A Very Short Introduction. Oxford University Press, 2020. http://dx.doi.org/10.1093/actrade/9780198807131.001.0001.
Full textBook chapters on the topic "Crystal engineering principles"
Zhang, Yue, Xue Gao, Jia Xiang Shang, and Xiao Ping Han. "First-Principles Calculations on Crystal Structure and Thermodynamic Properties of Ceramics." In Key Engineering Materials, 2517–20. Stafa: Trans Tech Publications Ltd., 2007. http://dx.doi.org/10.4028/0-87849-410-3.2517.
Full textAllen, Frank H. "Knowledge Acquisition from Crystallographic Databases: Applications in Molecular Modelling, Crystal Engineering and Structural Chemistry." In Fundamental Principles of Molecular Modeling, 105–18. Boston, MA: Springer US, 1996. http://dx.doi.org/10.1007/978-1-4899-0212-2_6.
Full textBoden, N., R. J. Bushby, J. Clements, R. Luo, and K. J. Donovan. "Design Principles for Engineering Conducting Discotic Liquid Crystals." In Molecular Engineering for Advanced Materials, 147–58. Dordrecht: Springer Netherlands, 1995. http://dx.doi.org/10.1007/978-94-015-8575-0_8.
Full textYevdokimov, Yu M., S. G. Skuridin, V. I. Salyanov, and W. K. Rybin. "General Principles of Creating Biosensing Units Based on Double-Stranded Nucleic Acid Liquid Crystals." In Topics in Molecular Organization and Engineering, 317–29. Dordrecht: Springer Netherlands, 1991. http://dx.doi.org/10.1007/978-94-011-3392-0_30.
Full textConway, Lewis J., Chris J. Pickard, and Andreas Hermann. "First principles crystal structure prediction." In Reference Module in Chemistry, Molecular Sciences and Chemical Engineering. Elsevier, 2022. http://dx.doi.org/10.1016/b978-0-12-823144-9.00173-4.
Full textSaha, Santanu. "Non-Destructive Evaluation of Residual Stresses in Welding." In Engineering Principles - Welding and Residual Stresses. IntechOpen, 2022. http://dx.doi.org/10.5772/intechopen.101638.
Full textHarish, Ajay Bangalore, and Dineshkumar Harursampath. "Algorithms and Principles for Intelligent Design of Flapping Wing Micro Aerial Vehicles." In Handbook of Research on Computational Intelligence for Engineering, Science, and Business, 521–55. IGI Global, 2013. http://dx.doi.org/10.4018/978-1-4666-2518-1.ch020.
Full textReiss-Husson, F., and D. Picot. "Crystallization of Membrane Proteins." In Crystallization of Nucleic Acids and Proteins. Oxford University Press, 1999. http://dx.doi.org/10.1093/oso/9780199636792.003.0013.
Full textCao, W. "Full-set material properties and domain engineering principles of ferroelectric single crystals." In Handbook of Advanced Dielectric, Piezoelectric and Ferroelectric Materials, 235–65. Elsevier, 2008. http://dx.doi.org/10.1533/9781845694005.2.235.
Full text"Full-set material properties and domain engineering principles of ferroelectric single crystals." In Handbook of Advanced Dielectric, Piezoelectric and Ferroelectric Materials. CRC Press, 2008. http://dx.doi.org/10.1201/9781439832882.ch9.
Full textConference papers on the topic "Crystal engineering principles"
Zengerle, Remigius, and Ottokar Leminger. "Principles of dispersion engineering in photonic crystal devices." In Optics East, edited by Michal F. Lipson, George Barbastathis, Achyut K. Dutta, and Kiyoshi Asakawa. SPIE, 2004. http://dx.doi.org/10.1117/12.579986.
Full textXiaochuan, Zeng, Li Xuejun, He Cuizhu, and Hu Qiaodan. "First-Principles Study on Adsorption Reaction of Oxygen Molecules on Fe (110) Crystal Surface." In 2022 29th International Conference on Nuclear Engineering. American Society of Mechanical Engineers, 2022. http://dx.doi.org/10.1115/icone29-92890.
Full textZhou, Zhong-Hao, Zhen Zhao, Hong-Bin Wang, and Zhi Li. "First-principles Calculations of Structures and Micro-cracks of the Al-Ni Crystal Materials." In 3rd Annual International Conference on Advanced Material Engineering (AME 2017). Paris, France: Atlantis Press, 2017. http://dx.doi.org/10.2991/ame-17.2017.24.
Full textZhang, Yuqin, Guoying Feng, and Shouhuan Zhou. "A first-principles study of the transition metals doped ZnSe crystal synthesized by vapor phase thermal diffusion method." In SPIE Nanoscience + Engineering, edited by Ganapathi S. Subramania and Stavroula Foteinopoulou. SPIE, 2016. http://dx.doi.org/10.1117/12.2236152.
Full textLi, Mei, Hua-Can He, and Yi Jin. "Principle, Equipment and Experiment of Vector-Matrix Multiplication by Liquid Crystal Array." In 2009 International Conference on Information Management and Engineering (ICIME 2009). IEEE, 2009. http://dx.doi.org/10.1109/icime.2009.34.
Full textGao, Feng, and Jianmin Qu. "Elastic Properties of (Cu,Ni)6Sn5 Ternary Crystal Structure Using First-Principle Approach." In ASME 2009 International Mechanical Engineering Congress and Exposition. ASMEDC, 2009. http://dx.doi.org/10.1115/imece2009-11130.
Full textLu, Chunhai, Wenkai Chen, Min Chen, Shijun Ni, and Chengjiang Zhang. "Electronic Structure and Mechanical Properties of Zircaloy-2 and Zircaloy-4: A First Principle Study." In 2013 21st International Conference on Nuclear Engineering. American Society of Mechanical Engineers, 2013. http://dx.doi.org/10.1115/icone21-15407.
Full textWang, Yue-Sheng, and A.-Li Chen. "Analysis of Band Structures of Nanosized Phononic Crystals by Nonlocal Elastic Theory." In ASME 2012 International Mechanical Engineering Congress and Exposition. American Society of Mechanical Engineers, 2012. http://dx.doi.org/10.1115/imece2012-86701.
Full textHao, Su, and Hans Weertman. "A Variational Principle of Dislocations Kinetic in Crystals and a Toughening Mechanism of BCC or HCP Metals." In ASME 2011 International Mechanical Engineering Congress and Exposition. ASMEDC, 2011. http://dx.doi.org/10.1115/imece2011-65605.
Full textChang, Guo-En, Chia-Ou Chang, Chan-Shin Chou, and Wen-Tien Chang Chien. "Silicon Micro-Ring Gyroscopes." In ASME 2007 International Mechanical Engineering Congress and Exposition. ASMEDC, 2007. http://dx.doi.org/10.1115/imece2007-42939.
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