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Calculating electronic stopping power in materials from first principles
ArticleAbstract: From the early models of electronic stopping power to the current first principles simulations, thePalabras claves:Electronic stopping power, First principles, Radiation effects, Time Dependent Density Functional TheoryAutores:Alfredo A. CorreaFuentes:scopusAdiabatic perturbation theory of electronic stopping in insulators
ArticleAbstract: A model able to explain the complicated structure of electronic stopping at low velocities in insulaPalabras claves:Autores:Alfredo A. Correa, Foulkes W.M.C., Horsfield A.P., Lim A.Fuentes:scopusElectron dynamics in extended systems within real-time time-dependent density-functional theory
ArticleAbstract: Abstract: Due to a beneficial balance of computational cost and accuracy, real-time time-dependent dPalabras claves:2d materials, Computation/computing, METAL, Quantum effects, Radiation effects, SemiconductingAutores:Alfredo A. Correa, Andrade X., Baczewski A.D., Constantinescu E., dos Santos T.P., Kanai Y., Kononov A., Lee C.W., Modine N., Robinson B., Schleife A., Yao Y.Fuentes:scopusElectron-phonon thermalization in a scalable method for real-time quantum dynamics
ArticleAbstract: We present a quantum simulation method that follows the dynamics of out-of-equilibrium many-body sysPalabras claves:Autores:Alfredo A. Correa, Kohanoff J.J., Rizzi V., Todorov T.N.Fuentes:scopusInq, a Modern GPU-Accelerated Computational Framework for (Time-Dependent) Density Functional Theory
ArticleAbstract: We present inq, a new implementation of density functional theory (DFT) and time-dependent DFT (TDDFPalabras claves:Autores:Alfredo A. Correa, Andrade X., Kartsev A., Lindenberg A., Ogitsu T., Pemmaraju C.D., Rajpurohit S., Tan L.Z., Xiao J.Fuentes:scopusSpectroscopic and magnetic mirages of impurities in nanoscopic systems
ArticleAbstract: Exact many-body calculation for impurities in nanoscopic systems with focusing properties was carriePalabras claves:Autores:Alfredo A. Correa, Balseiro C., Hallberg K.Fuentes:scopusUltrafast probe using femtosecond electron pulses: Real-time probing plasma dynamics
Conference ObjectAbstract: In recent years, femtosecond electron pulses have emerged as a powerful tool to probe ultrafast dynaPalabras claves:Autores:Alfredo A. Correa, Cao J., Chen J., Li J., Ogitsu T., Ping Y., Wang X., Zhou J.Fuentes:scopusSelf-interaction effects on charge-transfer collisions
ArticleAbstract: In this article, we investigate the role of the self-interaction error in the simulation of collisioPalabras claves:Autores:Alfredo A. Correa, Andrade X., Quashie E.E., Saha B.C.Fuentes:scopusWarm dense matter created by isochoric laser heating
ArticleAbstract: Warm Dense Matter (WDM) physics has been a growing field of high energy density physics, driven by tPalabras claves:Isochoric heating, Short pulse laser, Warm Dense MatterAutores:Alfredo A. Correa, Ao T., Collins G.W., Draeger E.W., Hanson D., Koslow I., Lee E., Ng A., Ogitsu T., Ping Y., Prendergast D.G., Price D.F., Schwegler E., Springer P.T., Tam H., Widmann K.Fuentes:scopusOctopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems
ArticleAbstract: Over the last few years, extraordinary advances in experimental and theoretical tools have allowed uPalabras claves:Autores:Alfredo A. Correa, Andrade X., Appel H., Borca C.H., Buchholz F., Castro A., Corni S., De Giovannini U., Delgado A., Eich F.G., Flick J., Gil G., Gomez A., Helbig N., Hübener H., Jestädt R., Jornet-Somoza J., Larsen A.H., Le Breton G., Lebedeva I.V., Lüders M., Marques M.A.L., Ohlmann S.T., Oliveira M.J.T., Pipolo S., Rampp M., Rozzi C.A., Rubio A., Sato S.A., Schäfer C., Strubbe D.A., Tancogne-Dejean N., Theophilou I., Welden A.Fuentes:scopus