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| Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
|---|---|---|---|
| 1 |
Material Type: Artigo
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AFLOW: An automatic framework for high-throughput materials discoveryCurtarolo, Stefano ; Setyawan, Wahyu ; Hart, Gus L.W. ; Jahnatek, Michal ; Chepulskii, Roman V. ; Taylor, Richard H. ; Wang, Shidong ; Xue, Junkai ; Yang, Kesong ; Levy, Ohad ; Mehl, Michael J. ; Stokes, Harold T. ; Demchenko, Denis O. ; Morgan, DaneComputational materials science, 2012-06, Vol.58, p.218-226 [Periódico revisado por pares]Amsterdam: Elsevier B.VTexto completo disponível |
| 2 |
Material Type: Artigo
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Polymorphs, Salts, and Cocrystals: What’s in a Name?Aitipamula, Srinivasulu ; Banerjee, Rahul ; Bansal, Arvind K ; Biradha, Kumar ; Cheney, Miranda L ; Choudhury, Angshuman Roy ; Desiraju, Gautam R ; Dikundwar, Amol G ; Dubey, Ritesh ; Duggirala, Nagakiran ; Ghogale, Preetam P ; Ghosh, Soumyajit ; Goswami, Pramod Kumar ; Goud, N. Rajesh ; Jetti, Ram R. K. R ; Karpinski, Piotr ; Kaushik, Poonam ; Kumar, Dinesh ; Kumar, Vineet ; Moulton, Brian ; Mukherjee, Arijit ; Mukherjee, Gargi ; Myerson, Allan S ; Puri, Vibha ; Ramanan, Arunachalam ; Rajamannar, T ; Reddy, C. Malla ; Rodriguez-Hornedo, Nair ; Rogers, Robin D ; Row, T. N. Guru ; Sanphui, Palash ; Shan, Ning ; Shete, Ganesh ; Singh, Amit ; Sun, Changquan C ; Swift, Jennifer A ; Thaimattam, Ram ; Thakur, Tejender S ; Kumar Thaper, Rajesh ; Thomas, Sajesh P ; Tothadi, Srinu ; Vangala, Venu R ; Variankaval, Narayan ; Vishweshwar, Peddy ; Weyna, David R ; Zaworotko, Michael JCrystal growth & design, 2012-05, Vol.12 (5), p.2147-2152 [Periódico revisado por pares]Washington,DC: American Chemical SocietyTexto completo disponível |
| 3 |
Material Type: Artigo
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AFLOWLIB.ORG: A distributed materials properties repository from high-throughput ab initio calculationsCurtarolo, Stefano ; Setyawan, Wahyu ; Wang, Shidong ; Xue, Junkai ; Yang, Kesong ; Taylor, Richard H. ; Nelson, Lance J. ; Hart, Gus L.W. ; Sanvito, Stefano ; Buongiorno-Nardelli, Marco ; Mingo, Natalio ; Levy, OhadComputational materials science, 2012-06, Vol.58 (C), p.227-235 [Periódico revisado por pares]Amsterdam: Elsevier B.VTexto completo disponível |
| 4 |
Material Type: Artigo
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Structural Changes of Cobalt-Based Perovskites upon Water Oxidation Investigated by EXAFSRisch, Marcel ; Grimaud, Alexis ; May, Kevin J ; Stoerzinger, Kelsey A ; Chen, Tina J ; Mansour, Azzam N ; Shao-Horn, YangJournal of physical chemistry. C, 2013-05, Vol.117 (17), p.8628-8635 [Periódico revisado por pares]Columbus, OH: American Chemical SocietyTexto completo disponível |
| 5 |
Material Type: Artigo
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Relaxing with relaxors: a review of relaxor ferroelectricsCowley, R. A. ; Gvasaliya, S. N. ; Lushnikov, S. G. ; Roessli, B. ; Rotaru, G. M.Advances in physics, 2011-04, Vol.60 (2), p.229-327 [Periódico revisado por pares]Taylor & FrancisTexto completo disponível |
| 6 |
Material Type: Artigo
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Zr- and Hf-Based Metal–Organic Frameworks: Tracking Down the PolymorphismBon, Volodymyr ; Senkovska, Irena ; Baburin, Igor A ; Kaskel, StefanCrystal growth & design, 2013-03, Vol.13 (3), p.1231-1237 [Periódico revisado por pares]Washington,DC: American Chemical SocietyTexto completo disponível |
| 7 |
Material Type: Artigo
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NucleationVEKILOV, Peter GCrystal growth & design, 2010-12, Vol.10 (12), p.5007-5019 [Periódico revisado por pares]Washington,DC: American Chemical SocietyTexto completo disponível |
| 8 |
Material Type: Artigo
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Polymorphism: A PerspectiveBERNSTEIN, JoelCrystal growth & design, 2011-03, Vol.11 (3), p.632-650 [Periódico revisado por pares]Washington,DC: American Chemical SocietyTexto completo disponível |
| 9 |
Material Type: Artigo
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Error Estimates for Solid-State Density-Functional Theory Predictions: An Overview by Means of the Ground-State Elemental CrystalsLejaeghere, K. ; Van Speybroeck, V. ; Van Oost, G. ; Cottenier, S.Critical reviews in solid state and materials sciences, 2014-01, Vol.39 (1), p.1-24 [Periódico revisado por pares]Colchester: Taylor & Francis GroupTexto completo disponível |
| 10 |
Material Type: Artigo
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Hirshfeld Surfaces Identify Inadequacies in Computations of Intermolecular Interactions in Crystals: Pentamorphic 1,8-DihydroxyanthraquinoneRohl, Andrew L ; Moret, Massimo ; Kaminsky, Werner ; Claborn, Kacey ; McKinnon, Joshua J ; Kahr, BartCrystal growth & design, 2008-12, Vol.8 (12), p.4517-4525 [Periódico revisado por pares]Washington,DC: American Chemical SocietyTexto completo disponível |
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