{"title":"Theoretical and computational methods for accelerated materials discovery","authors":"N. Zarkevich","doi":"10.1142/S0217984921300039","DOIUrl":"https://doi.org/10.1142/S0217984921300039","url":null,"abstract":"Predicting properties of materials and phase transformation using theoretical and computational multi-scale methods involving artificial intelligence and machine learning (ML) is important and high...","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"55 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"79116319","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Quantum Control of Cold Molecular Collisions Using Stark-Induced Adiabatic Raman Passage","authors":"William E. Perreault","doi":"10.1364/LS.2020.LM2F.3","DOIUrl":"https://doi.org/10.1364/LS.2020.LM2F.3","url":null,"abstract":"","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"47 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"77939972","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Fractons: the road to reality","authors":"M. Pretko","doi":"10.14288/1.0392548","DOIUrl":"https://doi.org/10.14288/1.0392548","url":null,"abstract":"","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"41 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"90177879","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
E. Stavrou, M. Bagge-Hansen, J. Hammons, M. Nielsen, B. Steele, Penghao Xiao, M. Kroonblawd, Matthew D. Nelms, W. L. Shaw, Will P. Bassett, S. Bastea, L. Lauderbach, R. Hodgin, Nicholas A. Perez-Marty, Saransh Singh, P. Das, Yuelin Li, Adam W Schuman, N. Sinclair, K. Fezzaa, A. Deriy, L. Leininger, T. Willey
{"title":"Detonation-induced transformation of graphite to hexagonal diamond","authors":"E. Stavrou, M. Bagge-Hansen, J. Hammons, M. Nielsen, B. Steele, Penghao Xiao, M. Kroonblawd, Matthew D. Nelms, W. L. Shaw, Will P. Bassett, S. Bastea, L. Lauderbach, R. Hodgin, Nicholas A. Perez-Marty, Saransh Singh, P. Das, Yuelin Li, Adam W Schuman, N. Sinclair, K. Fezzaa, A. Deriy, L. Leininger, T. Willey","doi":"10.1103/PHYSREVB.102.104116","DOIUrl":"https://doi.org/10.1103/PHYSREVB.102.104116","url":null,"abstract":"We explore the structural evolution of highly oriented pyrolytic graphite (HOPG) under detonation-induced shock conditions using in situ synchrotron x-ray diffraction in the ns timescale. We observe the formation of hexagonal diamond (lonsdaleite) at pressures above 50 GPa, in qualitative agreement with recent gas gun experiments. First-principles density functional calculations reveal that under uniaxial compression, the energy barrier for the transition toward hexagonal diamond is lower than that for cubic diamond. Finally, no indication of cubic diamond formation was observed up to $g70$ GPa.","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"6 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"89691509","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Aris Zhu, Jeffrey Wolberg, Farzad Koosha, Karena Etwaru, M. Rafailovich
{"title":"Characterization of a novel antimicrobial agent for endodontic applications","authors":"Aris Zhu, Jeffrey Wolberg, Farzad Koosha, Karena Etwaru, M. Rafailovich","doi":"10.1021/scimeetings.0c01307","DOIUrl":"https://doi.org/10.1021/scimeetings.0c01307","url":null,"abstract":"","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"21 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"83217445","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Role of defects in MAPbI3 to modulate optical absorption, and solar efficiency","authors":"P. Basera, S. Bhattacharya","doi":"10.1021/scimeetings.0c04393","DOIUrl":"https://doi.org/10.1021/scimeetings.0c04393","url":null,"abstract":"","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"13 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"88598254","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
B. Sirois, L. Fournier, J. Leduc, W. Witczak-Krempa
{"title":"Geometric entanglement in integer quantum Hall states","authors":"B. Sirois, L. Fournier, J. Leduc, W. Witczak-Krempa","doi":"10.1103/PHYSREVB.103.115115","DOIUrl":"https://doi.org/10.1103/PHYSREVB.103.115115","url":null,"abstract":"We study the quantum entanglement structure of integer quantum Hall states via the reduced density matrix of spatial subregions. In particular, we examine the eigenstates, spectrum and entanglement entropy (EE) of the density matrix for various ground and excited states, with or without mass anisotropy. We focus on an important class of regions that contain sharp corners or cusps, leading to a geometric angle-dependent contribution to the EE. We unravel surprising relations by comparing this corner term at different fillings. We further find that the corner term, when properly normalized, has nearly the same angle dependence as numerous conformal field theories (CFTs) in two spatial dimensions, which hints at a broader structure. In fact, the Hall corner term is found to obey bounds that were previously obtained for CFTs. In addition, the low-lying entanglement spectrum and the corresponding eigenfunctions reveal \"excitations\" localized near corners. Finally, we present an outlook for fractional quantum Hall states.","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"21 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"90313722","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
M. Hasan, C. Madasu, C. Kwong, F. Chevy, D. Wilkowski
{"title":"Dynamics of quantum gas in non-abelian gauge field","authors":"M. Hasan, C. Madasu, C. Kwong, F. Chevy, D. Wilkowski","doi":"10.32657/10356/152148","DOIUrl":"https://doi.org/10.32657/10356/152148","url":null,"abstract":"","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"23 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"76215180","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Multiscale Molecular Dynamics Simulations of Polaritonic Chemistry","authors":"G. Groenhof, J. Feist, J. J. Toppari","doi":"10.1021/acs.jctc.7b00388.s001","DOIUrl":"https://doi.org/10.1021/acs.jctc.7b00388.s001","url":null,"abstract":"","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"47 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"76617445","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Peculiar defects behavior in charge recombination of metal halide perovskites and conventional semiconductors","authors":"Weibin Chu, W. Saidi, Jin Zhao, O. Prezhdo","doi":"10.1021/scimeetings.0c07023","DOIUrl":"https://doi.org/10.1021/scimeetings.0c07023","url":null,"abstract":"","PeriodicalId":9375,"journal":{"name":"Bulletin of the American Physical Society","volume":"1 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2020-03-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"82335825","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}