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Daniel R. Nascimento

State University System of Florida

15H指数
35论文数
938被引数
收录论文 16
发表时间
Metal-Ligand Covalency in the Valence Excited States of Metal Dithiolenes Revealed by S 1s3p Resonant Inelastic X-ray ScatteringS 1s3p共振非弹性x射线散射揭示的金属二硫烯的价激发态中的金属-配体共价键
err2024-10-08
err0
errOAAI
errLarsen, Christopher B.; Ledbetter, Kathryn; Nascimento, Daniel R.; Biasin, Elisa; Qureshi, Muhammad; Nowak, Stanislaw H.; Sokaras, Dimosthenis; Govind, Niranjan; Cordones, Amy A.
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In Silico Ultrafast Nonlinear Spectroscopy Meets Experiments: The Case of Perylene Bisimide Dye
err2021-10-22
err9
errOAAI
errSegatta, Francesco; Russo, Mattia; Nascimento, Daniel R.; Presti, Davide; Rigodanza, Francesco; Nenov, Artur; Bonvicini, Andrea; Arcioni, Alberto; Mukamel, Shaul; Maiuri, Margherita; Muccioli, Luca; Govind, Niranjan; Cerullo, Giulio; Garavelli, Marco
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CLIFF: A component-based, machine-learned, intermolecular force field
err2021-05-14
err28
PREAI
errSchriber, Jeffrey B.; Nascimento, Daniel R.; Koutsoukas, Alexios; Spronk, Steven A.; Cheney, Daniel L.; Sherrill, C. David
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Resonant Inelastic X-ray Scattering Calculations of Transition Metal Complexes Within a Simplified Time-Dependent Density Functional Theory Framework
err2021-04-28
err19
errOAAI
errNascimento, Daniel R.; Biasin, Elisa; Poulter, Benjamin, I; Khalil, Munira; Sokaras, Dimosthenis; Govind, Niranjan
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iSPECTRON: A simulation interface for linear and nonlinear spectra with ab-initio quantum chemistry software
err2021-02-08
err19
errOAAI
errSegatta, Francesco; Nenov, Artur; Nascimento, Daniel R.; Govind, Niranjan; Mukamel, Shaul; Garavelli, Marco
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Revealing the bonding of solvated Ru complexes with valence-to-core resonant inelastic X-ray scattering
err2021-01-01
err24
errOAAI
errBiasin, Elisa; Nascimento, Daniel R.; Poulter, Benjamin I.; Abraham, Baxter; Kunnus, Kristjan; Garcia-Esparza, Angel T.; Nowak, Stanislaw H.; Kroll, Thomas; Schoenlein, Robert W.; Alonso-Mori, Roberto; Khalil, Munira; Govind, Niranjan; Sokaras, Dimosthenis
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Manipulating valence and core electronic excitations of a transition-metal complex using UV/Vis and X-ray cavities
err2021-01-01
err13
errOAAI
errGu, Bing; Cavaletto, Stefano M.; Nascimento, Daniel R.; Khalil, Munira; Govind, Niranjan; Mukamel, Shaul
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Relativistic Real-Time Time-Dependent Equation-of-Motion Coupled-Cluster
err2019-10-16
err48
PREAI
errKoulias, Lauren N.; Williams-Young, David B.; Nascimento, Daniel R.; DePrince, A. Eugene, III; Li, Xiaosong
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Elucidation of the photoaquation reaction mechanism in ferrous hexacyanide using synchrotron x-rays with sub-pulse-duration sensitivity
err2019-10-10
err29
errOAAI
errMarch, Anne Marie; Doumy, Gilles; Andersen, Amity; Al Haddad, Andre; Kumagai, Yoshiaki; Tu, Ming-Feng; Bang, Joohee; Bostedt, Christoph; Uhlig, Jens; Nascimento, Daniel R.; Assefa, Tadesse A.; Nemeth, Zoltan; Vanko, Gyorgy; Gawelda, Wojciech; Govind, Niranjan; Young, Linda
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The Chronus Quantum software packageChronus量子软件包
err2019-09-10
err91
errOAAI
errWilliams-Young, David B.; Petrone, Alessio; Sun, Shichao; Stetina, Torin F.; Lestrange, Patrick; Hoyer, Chad E.; Nascimento, Daniel R.; Koulias, Lauren; Wildman, Andrew; Kasper, Joseph; Goings, Joshua J.; Ding, Feizhi; DePrince, A. Eugene, III; Valeev, Edward F.; Li, Xiaosong
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PSI4NUMPY: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid Development
err2018-05-17
err129
PREAI
errSmith, Daniel G. A.; Burns, Lori A.; Sirianni, Dominic A.; Nascimento, Daniel R.; Kumar, Ashutosh; James, Andrew M.; Schriber, Jeffrey B.; Zhang, Tianyuan; Zhang, Boyi; Abbott, Adam S.; Berquist, Ericv J.; Lechner, Marvin H.; Cunha, Leonardo A.; Heide, Alexander G.; Waldrop, Jonathan M.; Takeshita, Tyler Y.; Alenaizan, Asem; Neuhauser, Daniel; King, Rollin A.; Simmonett, Andrew C.; Turney, Justin M.; Schaefer, Henry F.; Evangelista, Francesco A.; DePrince, A. Eugene, III; Crawford, T. Daniel; Patkowski, Konrad; Sherrill, C. David
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