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| 1 | Predicting superhard materials via a machine learning informed evolutionary structure search显示文摘The computational prediction of superhard materials would enable the in silico design of compounds that could be used in a wide variety of technological applications.Herein,good agreement was found between experimental Vickers hardnesses,Hv,of a wide range of materials and those calculated by three macroscopic hardness models that employ the shear and/or bulk moduli obtained from:(i)first principles via AFLOW-AEL(AFLOW Automatic Elastic Library),and(ii)a machine learning(ML)model trained on materials within the AFLOW repository.Because H^(ML)_(v) values can be quickly estimated,they can be used in conjunction with an evolutionary search to predict stable,superhard materials.This methodology is implemented in the XTALOPT evolutionary algorithm.Each crystal is minimized to the nearest local minimum,and its Vickers hardness is computed via a linear relationship with the shear modulus discovered by Teter.Both the energy/enthalpy and H^(ML)_(v),Teter are employed to determine a structure’s fitness.This implementation is applied towards the carbon system,and 43 new superhard phases are found.A topological analysis reveals that phases estimated to be slightly harder than diamond contain a substantial fraction of diamond and/or lonsdaleite. | Patrick Avery Xiaoyu Wang Corey Oses Eric Gossett Davide M.Proserpio Cormac Toher Stefano Curtarolo Eva Zurek | 2019 | npj Computational Materials2019，，1： | 7 |
| 2 | Localization of agmatine in vasopressin and oxytocln neurons of the rat hypothalamic paraventricular and supraoptic nuclei显示文摘 | Gorbatyuk OS Milner TA Wang G | 2002 | Exp Neurol2002，171，2： | 1 |
| 3 | The prevalence and treatment gap in epilepsy in China: an ILAE/IBE/WHO study显示文摘 | Wang WZ WuJZ Wang OS | 2003 | Neurology2003，60，9： | 1 |
| 4 | Induction of preneoplastic lung lesions in uinea pigs by cigarette smoke inhalation and their exacerbation by high dietary evels of vitamins C and E 显示文摘 | Fiala ES Sohn OS Wang CX | 2005 | Carcinogenesis2005，26，3： | 1 |
| 5 | Left ventricular untwisting rate by speckle tracking echocardiography显示文摘 | Wang J Khoury OS Yue Y | 2007 | Circulation2007，116，22： | 1 |
| 6 | Localization of agmatine in vasopressin and oxytocin neurons of the rat hypothalamic paraventricular and supraoptic nuclei显示文摘 | Gorbatyuk OS Milner TA Wang G | 2001 | Exp Neurol2001，171，2： | 1 |
| 7 | Evidence for endogenous agmatine in hypothalamo-neurohypophysial tract and its modulation on vasopressin release and Ca2+ channels显示文摘 | Wang G Gorbatyuk OS Dayanithi G | 2002 | Brain Res2002，932，12： | 1 |
| 8 | Increased nitric oxide synthase activity and expression in the human uterine artery during pregnancy显示文摘 | Nelson SH Steinsland OS Wang Y | 2000 | Circ Res2000，87，5： | 1 |
| 9 | Xuebijing Protects Rats from Sepsis Challenged with Acinetobacter baumannii by Promoting Annexin A1 Expression and Inhibiting Proinflammatory Cytokines Secretion显示文摘 | Xian-Di He Yan Wang Qiong Wu Hua-Xue Wang Zhen-Dong Chen Rong-Sheng Zheng Zi-Shu Wang Jun-Bin Wang Yan Yang José Luis Ríos | 2013 | Evidence-Based Complementary and Alternative Medicine2013，，： | 1 |
| 10 | Varicella-zoster virus activates inflammatory cytokines in human monocytes and macrophages via Toll-like receptor 2 显示文摘 | Wang JP Kurt-Jones EA Shin OS | 2005 | J Virol2005，79，12： | 1 |
| 11 | Increased nitric oxide synthase activity and expression in the human uterine artery during pregnancy 显示文摘 | Nelson SH Steinsland OS Wang Y | 2000 | Circ Res2000，87，5： | 1 |
| 12 | Prevalence of CKD and Comorbid Illness in Elderly Patients in the United States: Results From the Kidney Early Evaluation Program (KEEP)显示文摘 | Lesley A. Stevens Suying Li Changchun Wang Cindy Huang Bryan N. Becker Andrew S. Bomback Wendy Weinstock Brown Nilka Ríos Burrows Claudine T. Jurkovitz Samy I. McFarlane Keith C. Norris Michael Shlipak Adam T. Whaley-Connell Shu-Cheng Chen George L. Bakri | 2010 | American Journal of Kidney Diseases2010，，3： | 1 |
| 13 | Effect of aggregates on ex- tinction and surface-enhanced Raman scattering spectra of colloi- dal silver 显示文摘 | KERKER M SIIMAN OS WANG D | 1984 | J Phys C hem1984，88，15： | 1 |
| 14 | Induction of preneoplastic lung lesions in guinea pigs by cigarette smoke inhalation and their exacerbation by high dietary levels of vitamins C and E 显示文摘 | Fiala ES Sohn OS Wang CX | 2005 | Carcinogenesis2005，26，3： | 1 |
| 15 | The Quantal Nature of Ca2+ Sparks and in Situ Operation of the Ryanodine Receptor Array in Cardiac Cells显示文摘 | WANG Shi-qiang Stern M D Ríos E | 2004 | PNAS2004，101，11： | 1 |
| 16 | Overexpression of cyclin D1 and cyclin E in N-nitrosomethylbenzylamine-induced rat esophageal tumorigenesis显示文摘 | Wang OS Sabourin CL Wang H | 1996 | Carcinogenesis1996，17，： | 1 |
| 17 | Exposure to Chlamydia pneumoniae infection and age-related macular degeneration:The blue mountains eye study显示文摘 | Robman L Mahdi OS Wang JJ | 2007 | Invest Ophthalmol Vis Sci2007，48，9： | 1 |
| 18 | Relation of FGFR2 geneticpolymorphisms to the association between oral contraceptive useand the risk of breast cancer in Chinese women显示文摘 | Wang HX Xiao OS Jirong L | 2011 | Am J Epide-miol2011，173，8： | 1 |
| 19 | Clinical epidemiological analysis of the relationship between pancreatic cancer and diabetes mellitus: data from a single institution in China 显示文摘 | KUANG D JIN DA Y WANG OS | 2009 | J Dig Dis2009，10，1： | 1 |
| 20 | The Pax3 and Pax7 paralogs cooperate in neural and neural crest patterning using distinct molecular mechanisms,in Xenopus laevis embryos显示文摘 | Maczkowiak F Matéos S Wang Ee | 2010 | Developmental Biology2010，340，2： | 1 |
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