James E. Saal, Ph.D. - Related publications

2010 Pennsylvania State University, State College, PA, United States 
Materials Science Engineering, Condensed Matter Physics, Inorganic Chemistry
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50 most relevant papers in past 60 days:
Year Citation  Score
2021 Burrows SA, Korotkin I, Smoukov SK, Boek E, Karabasov S. Benchmarking of Molecular Dynamics Force Fields for Solid-Liquid and Solid-Solid Phase Transitions in Alkanes. The Journal of Physical Chemistry. B. PMID 33724846 DOI: 10.1021/acs.jpcb.0c07587   
2021 Serejo JAS, Pereira JS, Mouta R, Rego LGC. Sluggish anion transport provides good kinetic stability to the anhydrous anti-perovskite solid electrolyte LiOCl. Physical Chemistry Chemical Physics : Pccp. PMID 33730138 DOI: 10.1039/d1cp00593f   
2021 Singh AN, Dyre JC, Pedersen UR. Solid-liquid coexistence of neon, argon, krypton, and xenon studied by simulations. The Journal of Chemical Physics. 154: 134501. PMID 33832228 DOI: 10.1063/5.0045398   
2021 Ströker P, Hellmann R, Meier K. Systematic formulation of thermodynamic properties in the NpT ensemble. Physical Review. E. 103: 023305. PMID 33736048 DOI: 10.1103/PhysRevE.103.023305   
2021 Abdallah MM, Müller S, González de Castilla A, Gurikov P, Matias AA, Bronze MDR, Fernández N. Physicochemical Characterization and Simulation of the Solid-Liquid Equilibrium Phase Diagram of Terpene-Based Eutectic Solvent Systems. Molecules (Basel, Switzerland). 26. PMID 33806853 DOI: 10.3390/molecules26061801   
2021 Zhu T, Li Y, Gong H, Dong M. Phase Equilibrium and Density of CO + Acetic Acid Systems from 308.15 to 338.15 K and 15 to 45 MPa. Acs Omega. 6: 6663-6673. PMID 33748579 DOI: 10.1021/acsomega.0c05462   
2021 Gradenigo G, Iubini S, Livi R, Majumdar SN. Condensation transition and ensemble inequivalence in the discrete nonlinear Schrödinger equation. The European Physical Journal. E, Soft Matter. 44: 29. PMID 33710395 DOI: 10.1140/epje/s10189-021-00046-5   
2021 Li H, Jin Y, Jiang Y, Chen JZY. Determining the nonequilibrium criticality of a Gardner transition via a hybrid study of molecular simulations and machine learning. Proceedings of the National Academy of Sciences of the United States of America. 118. PMID 33836583 DOI: 10.1073/pnas.2017392118   
2021 Zhang GH, Nelson DR. Statistical mechanics of dislocation pileups in two dimensions. Physical Review. E. 103: 022139. PMID 33736078 DOI: 10.1103/PhysRevE.103.022139   
2021 Dong Z, Li W, Schönecker S, Jiang B, Vitos L. Invariant plastic deformation mechanism in paramagnetic nickel-iron alloys. Proceedings of the National Academy of Sciences of the United States of America. 118. PMID 33782128 DOI: 10.1073/pnas.2023181118   
2021 Liu L, Gadde SN, Stevens RJAM. Universal Wind Profile for Conventionally Neutral Atmospheric Boundary Layers. Physical Review Letters. 126: 104502. PMID 33784136 DOI: 10.1103/PhysRevLett.126.104502   
2021 Zhang M, Chen Y, Dai LH. Universal Scaling in the Temperature-Dependent Viscous Dynamics of Metallic Glasses. The Journal of Physical Chemistry. B. PMID 33764771 DOI: 10.1021/acs.jpcb.1c00034   
2021 Zhang G, Xu C, Wang M, Dong Y, Sun F, Ren X, Xu H, Zhao Y. Pressure effect of the mechanical, electronics and thermodynamic properties of Mg-B compounds A first-principles investigations. Scientific Reports. 11: 6096. PMID 33731866 DOI: 10.1038/s41598-021-85654-z   
2021 Luo X, Luan Y, Cai Y, Shen S. Heterogeneous irradiated-pristine polyethylene nanofiber junction as a high-performance solid-state thermal diode. Scientific Reports. 11: 5765. PMID 33707567 DOI: 10.1038/s41598-021-85140-6   
2021 Dharmarwardana M, Pakhira S, Welch RP, Caicedo-Narvaez C, Luzuriaga MA, Arimilli BS, McCandless GT, Fahimi B, Mendoza-Cortes JL, Gassensmith JJ. Rapidly Reversible Organic Crystalline Switch for Conversion of Heat into Mechanical Energy. Journal of the American Chemical Society. PMID 33822596 DOI: 10.1021/jacs.1c01549   
2021 Boström HLB, Collings IE, Daisenberger D, Ridley CJ, Funnell NP, Cairns AB. Probing the Influence of Defects, Hydration, and Composition on Prussian Blue Analogues with Pressure. Journal of the American Chemical Society. PMID 33629831 DOI: 10.1021/jacs.0c13181   
2021 Wang Y, Du C. Distribution Law of the Temperature Inversion Layer in a Deep Open-Pit Mine. Acs Omega. 6: 8693-8699. PMID 33817532 DOI: 10.1021/acsomega.1c00674   
2021 Das P, Procaccia I. Universal Density of Low-Frequency States in Amorphous Solids at Finite Temperatures. Physical Review Letters. 126: 085502. PMID 33709743 DOI: 10.1103/PhysRevLett.126.085502   
2021 Duan Y, Semin S, Tinnemans P, Xu J, Rasing T. Fully Controllable Structural Phase Transition in Thermomechanical Molecular Crystals with a Very Small Thermal Hysteresis. Small (Weinheim An Der Bergstrasse, Germany). e2006757. PMID 33709615 DOI: 10.1002/smll.202006757   
2021 Ghalambaz M, Mohammed HI, Naghizadeh A, Islam MS, Younis O, Mahdi JM, Chatroudi IS, Talebizadehsardari P. Optimum Placement of Heating Tubes in a Multi-Tube Latent Heat Thermal Energy Storage. Materials (Basel, Switzerland). 14. PMID 33807894 DOI: 10.3390/ma14051232   
2021 Enninful HRNB, Schneider D, Enke D, Valiullin R. Impact of Geometrical Disorder on Phase Equilibria of Fluids and Solids Confined in Mesoporous Materials. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 33724041 DOI: 10.1021/acs.langmuir.0c03047   
2021 Ghosh PS, Arya A, Basak CB, Poswal AK, Banerjee S. Chemical Ordering as a Precursor to Formation of Ordered δ-UZrPhase: A Theoretical and Experimental Study. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 33765664 DOI: 10.1088/1361-648X/abf20b   
2021 Rejali NA, Ye FD, Zuiter AM, Keller CC, Wittwer CT. Nearest-neighbour transition-state analysis for nucleic acid kinetics. Nucleic Acids Research. PMID 33823552 DOI: 10.1093/nar/gkab205   
2021 Skjærvø SL, Ong GK, Grendal OG, Wells KH, van Beek W, Ohara K, Milliron DJ, Tominaka S, Grande T, Einarsrud MA. Understanding the Hydrothermal Formation of NaNbO: Its Full Reaction Scheme and Kinetics. Inorganic Chemistry. PMID 33754706 DOI: 10.1021/acs.inorgchem.0c02763   
2021 Arafa AAM, Rashed ZZ, Ahmed SE. Radiative flow of non Newtonian nanofluids within inclined porous enclosures with time fractional derivative. Scientific Reports. 11: 5338. PMID 33674743 DOI: 10.1038/s41598-021-84848-9   
2021 Xia X, Van Hoesen DC, McKenzie ME, Youngman RE, Kelton KF. Low-temperature nucleation anomaly in silicate glasses shown to be artifact in a 5BaO·8SiO glass. Nature Communications. 12: 2026. PMID 33795656 DOI: 10.1038/s41467-021-22161-9   
2021 Yan L, Peng Y, Li T, Yan L, He S, Xu T. Thermodynamic Assessment of Bio-Oriented Ti-Ta-Sn System. Materials (Basel, Switzerland). 14. PMID 33806883 DOI: 10.3390/ma14061568   
2021 Piskulich ZA, Thompson WH. Examining the Role of Different Molecular Interactions on Activation Energies and Activation Volumes in Liquid Water. Journal of Chemical Theory and Computation. PMID 33819026 DOI: 10.1021/acs.jctc.0c01217   
2021 Brunk A, Duenweg B, Egger H, Habrich O, Lukacova-Medvidova M, Spiller D. Analysis of a viscoelastic phase separation model. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 33650988 DOI: 10.1088/1361-648X/abeb13   
2021 Lundin F, Hansen HW, Adrjanowicz K, Frick B, Rauber D, Hempelmann R, Shebanova O, Niss K, Matic A. Pressure and Temperature Dependence of Local Structure and Dynamics in an Ionic Liquid. The Journal of Physical Chemistry. B. 125: 2719-2728. PMID 33656344 DOI: 10.1021/acs.jpcb.1c00147   
2021 Marić V, Franchini F, Kuić D, Giampaolo SM. Resilience of the topological phases to frustration. Scientific Reports. 11: 6508. PMID 33753840 DOI: 10.1038/s41598-021-86009-4   
2021 Liu Y, Sun G, Xu L. Glass polyamorphism in gallium: Two amorphous solid states and their transformation on the potential energy landscape. The Journal of Chemical Physics. 154: 134503. PMID 33832248 DOI: 10.1063/5.0038058   
2021 Fai TG, Taylor JM, Virga EG, Zheng X, Palffy-Muhoray P. Leaky cell model of hard spheres. The Journal of Chemical Physics. 154: 104505. PMID 33722050 DOI: 10.1063/5.0037442   
2021 Duan X, Chen X, Zhu K, Long T, Huang S, Jerry FYH. The Thermo-Mechanical Coupling Effect in Selective Laser Melting of Aluminum Alloy Powder. Materials (Basel, Switzerland). 14. PMID 33805355 DOI: 10.3390/ma14071673   
2021 Rahman H, Yarali E, Zolfagharian A, Serjouei A, Bodaghi M. Energy Absorption and Mechanical Performance of Functionally Graded Soft-Hard Lattice Structures. Materials (Basel, Switzerland). 14. PMID 33799821 DOI: 10.3390/ma14061366   
2021 Lanigan-Atkins T, He X, Krogstad MJ, Pajerowski DM, Abernathy DL, Xu GNMN, Xu Z, Chung DY, Kanatzidis MG, Rosenkranz S, Osborn R, Delaire O. Two-dimensional overdamped fluctuations of the soft perovskite lattice in CsPbBr. Nature Materials. PMID 33723420 DOI: 10.1038/s41563-021-00947-y   
2021 Aina AA, Misquitta AJ, Price SL. A non-empirical intermolecular force-field for trinitrobenzene and its application in crystal structure prediction. The Journal of Chemical Physics. 154: 094123. PMID 33685142 DOI: 10.1063/5.0043746   
2021 Dong H, Liu G, Tong X. Influence of temperature-dependent acoustic and thermal parameters and nonlinear harmonics on the prediction of thermal lesion under HIFU ablation. Mathematical Biosciences and Engineering : Mbe. 18: 1340-1351. PMID 33757188 DOI: 10.3934/mbe.2021070   
2021 Chen Z, Shu C, Yang LM, Zhao X, Liu NY. Phase-field-simplified lattice Boltzmann method for modeling solid-liquid phase change. Physical Review. E. 103: 023308. PMID 33736036 DOI: 10.1103/PhysRevE.103.023308   
2021 Lu C, Chen C. Indentation Strengths of Zirconium Diboride: Intrinsic versus Extrinsic Mechanisms. The Journal of Physical Chemistry Letters. 2848-2853. PMID 33720728 DOI: 10.1021/acs.jpclett.1c00434   
2021 Yu T, Bauer FJ, Huber FJ, Will S, Cai W. 4D temperature measurements using tomographic two-color pyrometry. Optics Express. 29: 5304-5315. PMID 33726069 DOI: 10.1364/OE.412821   
2021 Zhao Y, Lv J, Zheng K, Tao J, Qin Y, Wang W, Wang C, Liang J. Multispectral radiometric temperature measurement algorithm for turbine blades based on moving narrow-band spectral windows. Optics Express. 29: 4405-4421. PMID 33771019 DOI: 10.1364/OE.414844   
2021 Zhao Y, Lv J, Zheng K, Tao J, Qin Y, Wang W, Wang C, Liang J. Multispectral radiometric temperature measurement algorithm for turbine blades based on moving narrow-band spectral windows. Optics Express. 29: 4405-4421. PMID 33771019 DOI: 10.1364/OE.414844   
2021 Begušić T, Vaníček J. Finite-Temperature, Anharmonicity, and Duschinsky Effects on the Two-Dimensional Electronic Spectra from Ab Initio Thermo-Field Gaussian Wavepacket Dynamics. The Journal of Physical Chemistry Letters. 2997-3005. PMID 33733773 DOI: 10.1021/acs.jpclett.1c00123   
2021 Bhat RV, Bera S. Out of equilibrium chiral higher order topological insulator on a π-flux square lattice. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 33752196 DOI: 10.1088/1361-648X/abf0c3   
2021 Paketurytė V, Petrauskas V, Zubrienė A, Abian O, Bastos M, Chen WY, Moreno MJ, Krainer G, Linkuvienė V, Sedivy A, Velazquez-Campoy A, Williams MA, Matulis D. Uncertainty in protein-ligand binding constants: asymmetric confidence intervals versus standard errors. European Biophysics Journal : Ebj. PMID 33837826 DOI: 10.1007/s00249-021-01518-4   
2021 Rajagopal MC, Sinha S. Cellular Thermometry Considerations for Probing Biochemical Pathways. Cell Biochemistry and Biophysics. PMID 33797706 DOI: 10.1007/s12013-021-00979-w   
2021 Ranieri U, Klotz S, Gaal R, Koza MM, Bove LE. Diffusion in dense supercritical methane from quasi-elastic neutron scattering measurements. Nature Communications. 12: 1958. PMID 33785748 DOI: 10.1038/s41467-021-22182-4   
2021 Zhou G. Modeling the thermal behavior of an acoustically driven gas bubble. The Journal of the Acoustical Society of America. 149: 923. PMID 33639813 DOI: 10.1121/10.0003439   
2021 Zhou G. Modeling the thermal behavior of an acoustically driven gas bubble. The Journal of the Acoustical Society of America. 149: 923. PMID 33639813 DOI: 10.1121/10.0003439