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Iulia Emilia Brumboiu

nicolaus copernicus university in torun

14H指数
59论文数
622被引数
收录论文 22
发表时间
Decoding orbital interactions in H-bonded melamine networks by combining electron spectroscopy and DFT通过结合电子能谱和DFT解码氢键联三聚氰胺网络中的轨道相互作用
err2026-09-02
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PREAI
errIulia Emilia Brumboiu Corresponding Author; Cesare Grazioli; Matuš Stredansky; Teng Zhang; Monica de Simone; Marcello Coreno; Carla Puglia; Barbara Brena; Valeria Lanzilotto Corresponding Author
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VeloxChem: Large-Scale DFT Calculations of Geometric Derivatives up to Second Order for Simulation of IR Spectra
err2026-01-06
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errOAAI
errJosefine H. Andersen; Iulia Emilia Brumboiu; Manuel Hodecker; Xin Li; Patrick Norman; Zilvinas Rinkevicius
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VeloxChem Quantum–Classical Interoperability for Modeling of Complex Molecular SystemsVeloxChem 量子-经典互操作性:复杂分子系统的建模
err2025-08-03
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PREAI
errJuan Angel de Gracia Triviño; Iulia Emilia Brumboiu; David Carrasco-Busturia; Xin Li; Chenxi Li; Mathieu Linares; Valentin Lindfeld; Young Min Rhee; Julia Rune; Bastiaan van Hoorn; Patrick Norman; Mårten S. G. Ahlquist
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From Chains to Arrays: Substrate-Mediated Self-Assembly of Diboron Molecules从链到阵列: 底物介导的二硼分子自组装
err2024-12-05
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errOAAI
errHao, Xiaoyu; Yang, Huixia; Niu, Mengmeng; Wang, Tingting; Ji, Hongyan; Brumboiu, Iulia Emilia; Grazioli, Cesare; Guarnaccio, Ambra; Cossaro, Albano; Li, Yan; Qiao, Jingsi; Zhang, Quanzhen; Liu, Liwei; Zhang, Teng; Wang, Yeliang
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m-MTDATA on Au(111): Spectroscopic Evidence of Molecule-Substrate Interactions
err2022-02-08
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PREAI
errZhang, Teng; Grazioli, Cesare; Guarnaccio, Ambra; Brumboiu, Iulia Emilia; Lanzilotto, Valeria; Johansson, Fredrik O. L.; Beranova, Klara; Coreno, Marcello; de Simone, Monica; Brena, Barbara; Puglia, Carla
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Clarifying the Adsorption of Triphenylamine on Au(111): Filling the HOMO-LUMO Gap
err2022-01-17
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errOAAI
errZhang, Teng; Svensson, Pamela H. W.; Brumboiu, Iulia Emilia; Lanzilotto, Valeria; Grazioli, Cesare; Guarnaccio, Ambra; Johansson, Fredrik O. L.; Beranova, Klara; Coreno, Marcello; de Simone, Monica; Floreano, Luca; Cossaro, Albano; Brena, Barbara; Puglia, Carla
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Analytical gradients for core-excited states in the algebraic diagrammatic construction (ADC) framework
err2021-07-29
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errOAAI
errBrumboiu, Iulia Emilia; Rehn, Dirk R.; Dreuw, Andreas; Rhee, Young Min; Norman, Patrick
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Hydrogen bond effects in multimode nuclear dynamics of acetic acid observed via resonant x-ray scattering
err2021-06-07
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errOAAI
errSavchenko, Viktoriia; Ekholm, Victor; Brumboiu, Iulia Emilia; Norman, Patrick; Pietzsch, Annette; Foehlisch, Alexander; Rubensson, Jan-Erik; Grasjoe, Johan; Bjorneholm, Olle; Sathe, Conny; Dong, Minjie; Schmitt, Thorsten; McNally, Daniel; Lu, Xingye; Krasnov, Pavel; Polyutov, Sergey P.; Gel'mukhanov, Faris; Odelius, Michael; Kimberg, Victor
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Gator: A Python-driven program for spectroscopy simulations using correlated wave functionsGator: 使用相关波函数进行光谱模拟的Python驱动程序
err2021-03-17
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errOAAI
errRehn, Dirk R.; Rinkevicius, Zilvinas; Herbst, Michael F.; Li, Xin; Scheurer, Maximilian; Brand, Manuel; Dempwolff, Adrian L.; Brumboiu, Iulia E.; Fransson, Thomas; Dreuw, Andreas; Norman, Patrick
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Vibrational resonant inelastic X-ray scattering in liquid acetic acid: a ruler for molecular chain lengths
err2021-02-18
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errOAAI
errSavchenko, Viktoriia; Brumboiu, Iulia Emilia; Kimberg, Victor; Odelius, Michael; Krasnov, Pavel; Liu, Ji-Cai; Rubensson, Jan-Erik; Bjorneholm, Olle; Sathe, Conny; Grasjo, Johan; Dong, Minjie; Pietzsch, Annette; Foehlisch, Alexander; Schmitt, Thorsten; McNally, Daniel; Lu, Xingye; Polyutov, Sergey P.; Norman, Patrick; Iannuzzi, Marcella; Gel'mukhanov, Faris; Ekholm, Victor
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XABOOM: An X-ray Absorption Benchmark of Organic Molecules Based on Carbon, Nitrogen, and Oxygen 1s → π* Transitions
err2021-02-05
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errOAAI
errFransson, Thomas; Brumboiu, Iulia E.; Vidal, Marta L.; Norman, Patrick; Coriani, Sonia; Dreuw, Andreas
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Atomic photoionization cross sections beyond the electric dipole approximation
err2019-01-29
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errOAAI
errBrumboiu, Iulia Emilia; Eriksson, Olle; Norman, Patrick
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Lone-Pair Delocalization Effects within Electron Donor Molecules: The Case of Triphenylamine and Its Thiophene-Analog电子供体分子内的孤对离域效应: 三苯胺及其噻吩类似物的情况
err2018-07-12
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PREAI
errZhang, T.; Brumboiu, I. E.; Grazioli, C.; Guarnaccio, A.; Coreno, M.; de Simone, M.; Santagata, A.; Rensmo, H.; Brena, B.; Lanzilotto, V.; Puglia, C.
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Conclusively Addressing the CoPc Electronic Structure: A Joint Gas-Phase and Solid-State Photoemission and Absorption Spectroscopy Study
err2017-11-16
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errOAAI
errZhang, T.; Brumboiu, I. E.; Lanzilotto, V.; Luder, J.; Grazioli, C.; Giangrisostomi, E.; Ovsyannikov, R.; Sass, Y.; Bidermane, I.; Stupar, M.; de Simone, M.; Coreno, M.; Ressel, B.; Pedio, M.; Rudolf, P.; Brena, B.; Puglia, C.
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Valence electronic structure of cobalt phthalocyanine from an optimally tuned range-separated hybrid functional
err2017-07-24
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PREAI
errBrumboiu, Iulia Emilia; Prokopiou, Georgia; Kronik, Leeor; Brena, Barbara
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Influence of Electron Correlation on the Electronic Structure and Magnetism of Transition-Metal Phthalocyanines
err2016-03-14
err57
PREAI
errBrumboiu, Iulia Emilia; Haldar, Soumyajyoti; Luder, Johann; Eriksson, Olle; Herper, Heike C.; Brena, Barbara; Sanyal, Biplab
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