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Maximilian Amsler - Publications

Affiliations: 
Cornell University, Ithaca, NY, United States 
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60 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2022 Goesten MG, Xia Y, Aschauer U, Amsler M. Conformational Gap Control in CsTaS. Journal of the American Chemical Society. PMID 35174711 DOI: 10.1021/jacs.1c10947  0.728
2021 Boeri L, Hennig RG, Hirschfeld PJ, Profeta G, Sanna A, Zurek E, Pickett WE, Amsler M, Dias R, Eremets M, Heil C, Hemley R, Liu H, Ma Y, Pierleoni C, et al. The 2021 Room-Temperature Superconductivity Roadmap. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 34544070 DOI: 10.1088/1361-648X/ac2864  0.56
2020 Saha S, Di Cataldo S, Amsler M, von der Linden W, Boeri L. High-temperature conventional superconductivity in the boron-carbon system: Material trends Physical Review B. 102. DOI: 10.1103/Physrevb.102.024519  0.381
2020 Amsler M, Rostami S, Tahmasbi H, Khajehpasha ER, Faraji S, Rasoulkhani R, Ghasemi SA. FLAME: A library of atomistic modeling environments Computer Physics Communications. 256: 107415. DOI: 10.1016/J.Cpc.2020.107415  0.373
2019 Singh S, Zanolli Z, Amsler M, Belhadji B, Sofo JO, Verstraete MJ, Romero AH. Low Energy Phases of Bi Monolayer Predicted by Structure Search in Two Dimensions. The Journal of Physical Chemistry Letters. PMID 31682118 DOI: 10.1021/Acs.Jpclett.9B03043  0.435
2019 Amsler M, Ward L, Hegde VI, Goesten MG, Yi X, Wolverton C. Ternary mixed-anion semiconductors with tunable band gaps from machine-learning and crystal structure prediction Physical Review Materials. 3. DOI: 10.1103/Physrevmaterials.3.035404  0.565
2019 Amsler M. Thermodynamics and superconductivity of S x Se 1 -x H 3 Physical Review B. 99: 60102. DOI: 10.1103/Physrevb.99.060102  0.336
2019 Dutta D, De DS, Fan D, Roy S, Alfieri G, Camarda M, Amsler M, Lehmann J, Bartolf H, Goedecker S, Jung TA. Evidence for carbon clusters present near thermal gate oxides affecting the electronic band structure in SiC-MOSFET Applied Physics Letters. 115: 101601. DOI: 10.1063/1.5112779  0.604
2019 Sun Y, Amsler M, Goedecker S, Caravella A, Yoshida M, Kato M. Surfactant-assisted synthesis of large Cu-BTC MOF single crystals and their potential utilization as photodetectors Crystengcomm. 21: 3948-3953. DOI: 10.1039/C9Ce00440H  0.541
2018 Rostami S, Amsler M, Ghasemi SA. Optimized symmetry functions for machine-learning interatomic potentials of multicomponent systems. The Journal of Chemical Physics. 149: 124106. PMID 30278670 DOI: 10.1063/1.5040005  0.362
2018 Kim S, Hegde VI, Yao Z, Lu Z, Amsler M, He J, Hao S, Croy JR, Lee E, Thackeray MM, Wolverton C. First-principles Study of Lithium Cobalt Spinel Oxides: Correlating Structure and Electrochemistry. Acs Applied Materials & Interfaces. PMID 29616800 DOI: 10.1021/Acsami.8B00394  0.698
2018 Amsler M, Hegde VI, Jacobsen SD, Wolverton C. Exploring the High-Pressure Materials Genome Physical Review X. 8. DOI: 10.1103/Physrevx.8.041021  0.582
2018 Flores-Livas JA, Tomerini D, Amsler M, Boziki A, Rothlisberger U, Goedecker S. Emergence of hidden phases of methylammonium lead iodide (CH3NH3PbI3) upon compression Physical Review Materials. 2. DOI: 10.1103/Physrevmaterials.2.085201  0.67
2018 He J, Naghavi SS, Hegde VI, Amsler M, Wolverton C. Designing and Discovering a New Family of Semiconducting Quaternary Heusler Compounds Based on the 18-Electron Rule Chemistry of Materials. 30: 4978-4985. DOI: 10.1021/Acs.Chemmater.8B01096  0.552
2018 Mohr S, Eixarch M, Amsler M, Mantsinen MJ, Genovese L. Linear scaling DFT calculations for large tungsten systems using an optimized local basis Nuclear Materials and Energy. 15: 64-70. DOI: 10.1016/J.Nme.2018.01.002  0.342
2018 Wang D, Amsler M, Hegde VI, Saal JE, Issa A, Zhou B, Zeng X, Wolverton C. Crystal structure, energetics, and phase stability of strengthening precipitates in Mg alloys: A first-principles study Acta Materialia. 158: 65-78. DOI: 10.1016/J.Actamat.2018.07.041  0.695
2017 Powderly KM, Clarke SM, Amsler M, Wolverton C, Malliakas CD, Meng Y, Jacobsen SD, Freedman DE. High-pressure discovery of β-NiBi. Chemical Communications (Cambridge, England). PMID 28959808 DOI: 10.1039/C7Cc06471C  0.509
2017 Amsler M, Naghavi SS, Wolverton C. Prediction of superconducting iron-bismuth intermetallic compounds at high pressure. Chemical Science. 8: 2226-2234. PMID 28507678 DOI: 10.1039/C6Sc04683E  0.54
2017 Fisicaro G, Sicher M, Amsler M, Saha S, Genovese L, Goedecker S. Surface reconstruction of fluorites in vacuum and aqueous environment Physical Review Materials. 1. DOI: 10.1103/Physrevmaterials.1.033609  0.587
2017 Amsler M, Wolverton CM. Dense superconducting phases of copper-bismuth at high pressure Physical Review Materials. 1: 31801. DOI: 10.1103/Physrevmaterials.1.031801  0.339
2017 Faraji S, Ghasemi SA, Rostami S, Rasoulkhani R, Schaefer B, Goedecker S, Amsler M. High accuracy and transferability of a neural network potential through charge equilibration for calcium fluoride Physical Review B. 95. DOI: 10.1103/Physrevb.95.104105  0.514
2017 Amsler M, Yao Z, Wolverton C. Cubine, a Quasi Two-Dimensional Copper–Bismuth Nanosheet Chemistry of Materials. 29: 9819-9828. DOI: 10.1021/Acs.Chemmater.7B03997  0.664
2017 Eivari HA, Ghasemi SA, Tahmasbi H, Rostami S, Faraji S, Rasoulkhani R, Goedecker S, Amsler M. Two-Dimensional Hexagonal Sheet of TiO2 Chemistry of Materials. 29: 8594-8603. DOI: 10.1021/Acs.Chemmater.7B02031  0.658
2017 Clarke SM, Amsler M, Walsh JPS, Yu T, Wang Y, Meng Y, Jacobsen SD, Wolverton C, Freedman DE. Creating Binary Cu–Bi Compounds via High-Pressure Synthesis: A Combined Experimental and Theoretical Study Chemistry of Materials. 29: 5276-5285. DOI: 10.1021/Acs.Chemmater.7B01418  0.57
2017 Ohno S, Aydemir U, Amsler M, Pöhls J, Chanakian S, Zevalkink A, White MA, Bux SK, Wolverton C, Snyder GJ. Achieving zT > 1 in Inexpensive Zintl Phase Ca9 Zn4+ x Sb9 by Phase Boundary Mapping Advanced Functional Materials. 27: 1606361. DOI: 10.1002/Adfm.201606361  0.526
2016 Clarke SM, Walsh JP, Amsler M, Malliakas CD, Yu T, Goedecker S, Wang Y, Wolverton C, Freedman DE. Discovery of a Superconducting Cu-Bi Intermetallic Compound by High-Pressure Synthesis. Angewandte Chemie (International Ed. in English). PMID 27666749 DOI: 10.1002/Anie.201605902  0.68
2016 He J, Amsler M, Xia Y, Naghavi SS, Hegde VI, Hao S, Goedecker S, Ozoliņš V, Wolverton C. Ultralow Thermal Conductivity in Full Heusler Semiconductors. Physical Review Letters. 117: 046602. PMID 27494488 DOI: 10.1103/Physrevlett.117.046602  0.666
2016 Zhu L, Amsler M, Fuhrer T, Schaefer B, Faraji S, Rostami S, Ghasemi SA, Sadeghi A, Grauzinyte M, Wolverton C, Goedecker S. A fingerprint based metric for measuring similarities of crystalline structures. The Journal of Chemical Physics. 144: 034203. PMID 26801027 DOI: 10.1063/1.4940026  0.698
2016 Flores-Livas JA, Amsler M, Heil C, Sanna A, Boeri L, Profeta G, Wolverton C, Goedecker S, Gross EKU. Superconductivity in metastable phases of phosphorus-hydride compounds under high pressure Physical Review B. 93. DOI: 10.1103/Physrevb.93.020508  0.645
2016 Amsler M, Goedecker S, Zeier WG, Snyder GJ, Wolverton C, Chaput L. ZnSb Polymorphs with Improved Thermoelectric Properties Chemistry of Materials. 28: 2912-2920. DOI: 10.1021/Acs.Chemmater.5B03856  0.687
2016 Valencia-Jaime I, Sarmiento-Pérez R, Botti S, Marques MAL, Amsler M, Goedecker S, Romero AH. Novel crystal structures for lithium-silicon alloy predicted by minima hopping method Journal of Alloys and Compounds. 655: 147-154. DOI: 10.1016/J.Jallcom.2015.09.101  0.673
2015 Cerqueira TF, Sarmiento-Pérez R, Amsler M, Nogueira F, Botti S, Marques MA. Materials Design On-the-Fly. Journal of Chemical Theory and Computation. 11: 3955-60. PMID 26574474 DOI: 10.1021/Acs.Jctc.5B00212  0.388
2015 Sarmiento-Pérez R, Cerqueira TF, Valencia-Jaime I, Amsler M, Goedecker S, Romero AH, Botti S, Marques MA. Novel phases of lithium-aluminum binaries from first-principles structural search. The Journal of Chemical Physics. 142: 024710. PMID 25591380 DOI: 10.1063/1.4905141  0.634
2015 Amsler M, Botti S, Marques MAL, Lenosky TJ, Goedecker S. Low-density silicon allotropes for photovoltaic applications Physical Review B. 92. DOI: 10.1103/Physrevb.92.014101  0.644
2015 Cerqueira TFT, Lin S, Amsler M, Goedecker S, Botti S, Marques MAL. Identification of Novel Cu, Ag, and Au Ternary Oxides from Global Structural Prediction Chemistry of Materials. 27: 4562-4573. DOI: 10.1021/Acs.Chemmater.5B00716  0.64
2014 Schaefer B, Pal R, Khetrapal NS, Amsler M, Sadeghi A, Blum V, Zeng XC, Goedecker S, Wang LS. Isomerism and structural fluxionality in the Au26 and Au26(-) nanoclusters. Acs Nano. 8: 7413-22. PMID 24960331 DOI: 10.1021/Nn502641Q  0.615
2014 Schaefer B, Mohr S, Amsler M, Goedecker S. Minima hopping guided path search: an efficient method for finding complex chemical reaction pathways. The Journal of Chemical Physics. 140: 214102. PMID 24907985 DOI: 10.1063/1.4878944  0.602
2014 Amsler M, Flores-Livas JA, Botti S, Marques MA, Goedecker S. Comment on "Towards direct-gap silicon phases by the inverse band structure design approach". Physical Review Letters. 112: 199801. PMID 24877972 DOI: 10.1103/Physrevlett.112.199801  0.568
2014 Tran HD, Amsler M, Botti S, Marques MA, Goedecker S. First-principles predicted low-energy structures of NaSc(BH4)4. The Journal of Chemical Physics. 140: 124708. PMID 24697471 DOI: 10.1063/1.4869194  0.672
2014 Ghasemi SA, Lenosky TJ, Amsler M, Sadeghi A, Genovese L, Goedecker S. Energetic and vibrational analysis of hydrogenated silicon m vacancies above saturation Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.054117  0.604
2014 Mohr S, Pochet P, Amsler M, Schaefer B, Sadeghi A, Genovese L, Goedecker S. Boron aggregation in the ground states of boron-carbon fullerenes Physical Review B - Condensed Matter and Materials Physics. 89. DOI: 10.1103/Physrevb.89.041404  0.614
2013 Vergniory MG, Marques MA, Botti S, Amsler M, Goedecker S, Chulkov EV, Ernst A, Romero AH. Comment on "Topological insulators in ternary compounds with a honeycomb lattice". Physical Review Letters. 110: 129701. PMID 25166853 DOI: 10.1103/Physrevlett.110.129701  0.539
2013 Amsler M, Botti S, Marques MA, Goedecker S. Conducting boron sheets formed by the reconstruction of the α-boron (111) surface. Physical Review Letters. 111: 136101. PMID 24116795 DOI: 10.1103/Physrevlett.111.136101  0.613
2013 Huan TD, Amsler M, Marques MA, Botti S, Willand A, Goedecker S. Low-energy polymeric phases of alanates. Physical Review Letters. 110: 135502. PMID 23581335 DOI: 10.1103/Physrevlett.110.135502  0.635
2013 Cerqueira TFT, Sarmiento-Perez R, Trani F, Amsler M, Goedecker S, Marques MAL, Botti S. The crystal structure of p-type transparent conductive oxide CuBO2 Mrs Communications. 3: 157-160. DOI: 10.1557/Mrc.2013.21  0.641
2013 Amsler M, Flores-Livas JA, Marques MA, Botti S, Goedecker S. Prediction of a novel monoclinic carbon allotrope The European Physical Journal B. 86. DOI: 10.1140/Epjb/E2013-40639-4  0.619
2013 Huan TD, Amsler M, Sabatini R, Tuoc VN, Le NB, Woods LM, Marzari N, Goedecker S. Thermodynamic stability of alkali-metal-zinc double-cation borohydrides at low temperatures Physical Review B - Condensed Matter and Materials Physics. 88. DOI: 10.1103/Physrevb.88.024108  0.649
2013 Botti S, Amsler M, Flores-Livas JA, Ceria P, Goedecker S, Marques MAL. Carbon structures and defect planes in diamond at high pressure Physical Review B. 88. DOI: 10.1103/Physrevb.88.014102  0.625
2013 Sarmiento-Pérez R, Cerqueira TFT, Valencia-Jaime I, Amsler M, Goedecker S, Botti S, Marques MAL, Romero AH. Sodium–gold binaries: novel structures for ionic compounds from anab initiostructural search New Journal of Physics. 15: 115007. DOI: 10.1088/1367-2630/15/11/115007  0.668
2012 Amsler M, Flores-Livas JA, Huan TD, Botti S, Marques MA, Goedecker S. Novel structural motifs in low energy phases of LiAlH4. Physical Review Letters. 108: 205505. PMID 23003156 DOI: 10.1103/Physrevlett.108.205505  0.686
2012 Flores-Livas JA, Amsler M, Lenosky TJ, Lehtovaara L, Botti S, Marques MA, Goedecker S. High-pressure structures of disilane and their superconducting properties. Physical Review Letters. 108: 117004. PMID 22540502 DOI: 10.1103/Physrevlett.108.117004  0.635
2012 Amsler M, Flores-Livas JA, Lehtovaara L, Balima F, Ghasemi SA, Machon D, Pailhès S, Willand A, Caliste D, Botti S, San Miguel A, Goedecker S, Marques MA. Crystal structure of cold compressed graphite. Physical Review Letters. 108: 065501. PMID 22401083 DOI: 10.1103/Physrevlett.108.065501  0.622
2012 Amsler M, Flores-Livas JA, Huan TD, Botti S, Marques MAL, Goedecker S. Novel structural motifs in low energy phases of LiAlH 4 Physical Review Letters. 108. DOI: 10.1103/PhysRevLett.108.205505  0.601
2012 Huan TD, Amsler M, Tuoc VN, Willand A, Goedecker S. Low-energy structures of zinc borohydride Zn(BH4)2 Physical Review B - Condensed Matter and Materials Physics. 86. DOI: 10.1103/Physrevb.86.224110  0.671
2012 Botti S, Flores-Livas JA, Amsler M, Goedecker S, Marques MAL. Low-energy silicon allotropes with strong absorption in the visible for photovoltaic applications Physical Review B. 86. DOI: 10.1103/Physrevb.86.121204  0.611
2012 Flores-Livas JA, Lehtovaara L, Amsler M, Goedecker S, Pailhès S, Botti S, San Miguel A, Marques MAL. Raman activity of sp3 carbon allotropes under pressure: A density functional theory study Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.155428  0.587
2011 De S, Willand A, Amsler M, Pochet P, Genovese L, Goedecker S. Energy landscape of fullerene materials: a comparison of boron to boron nitride and carbon. Physical Review Letters. 106: 225502. PMID 21702613 DOI: 10.1103/Physrevlett.106.225502  0.622
2010 Amsler M, Goedecker S. Crystal structure prediction using the minima hopping method. The Journal of Chemical Physics. 133: 224104. PMID 21171680 DOI: 10.1063/1.3512900  0.635
2010 Ghasemi SA, Amsler M, Hennig RG, Roy S, Goedecker S, Lenosky TJ, Umrigar CJ, Genovese L, Morishita T, Nishio K. Energy landscape of silicon systems and its description by force fields, tight binding schemes, density functional methods, and quantum Monte Carlo methods Physical Review B. 81. DOI: 10.1103/Physrevb.81.214107  0.704
2009 Amsler M, Alireza Ghasemi S, Goedecker S, Neelov A, Genovese L. Adsorption of small NaCl clusters on surfaces of silicon nanostructures. Nanotechnology. 20: 445301. PMID 19801776 DOI: 10.1088/0957-4484/20/44/445301  0.568
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