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Controlling optoelectronic properties through protonation with π-extended triphenodioxazine diimides Kumar, Rhea; Taddei, Mario; Petropoulos, Vasilis; Russo, Mattia; Vernuccio, Federico; Cerullo, Giulio; Polli, Dario; Nenov, Artur; Demitri, Nicola; Prato, Maurizio; Maiuri, Margherita; Dosso, Jacopo Share Save
Sub-100-fs energy transfer in coenzyme NADH is a coherent process assisted by a charge-transfer state Jaiswal, Vishal Kumar; Ruiz, Daniel Aranda; Petropoulos, Vasilis; Kabacinski, Piotr; Montorsi, Francesco; Uboldi, Lorenzo; Ugolini, Simone; Mukamel, Shaul; Cerullo, Giulio; Garavelli, Marco; Santoro, Fabrizio; Nenov, Artur Share Save
WFOT: A Wave Function Overlap Tool between Single- and Multi-Reference Electronic Structure Methods for Spectroscopy Simulation Loreti, Alessandro; Freixas, Victor Manuel; Avagliano, Davide; Segatta, Francesco; Song, Huajing; Tretiak, Sergei; Mukamel, Shaul; Garavelli, Marco; Govind, Niranjan; Nenov, Artur Share Save
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The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry Manni, Giovanni Li; Galvan, Ignacio Fdez.; Alavi, Ali; Aleotti, Flavia; Aquilante, Francesco; Autschbach, Jochen; Avagliano, Davide; Baiardi, Alberto; Bao, Jie J.; Battaglia, Stefano; Birnoschi, Letitia; Blanco-Gonzalez, Alejandro; Bokarev, Sergey I.; Broer, Ria; Cacciari, Roberto; Calio, Paul B.; Carlson, Rebecca K.; Couto, Rafael Carvalho; Cerdan, Luis; Chibotaru, Liviu F.; Chilton, Nicholas F.; Church, Jonathan Richard; Conti, Irene; Coriani, Sonia; Cuellar-Zuquin, Juliana; Daoud, Razan E.; Dattani, Nike; Decleva, Piero; de Graaf, Coen; Delcey, Mickael G.; De Vico, Luca; Dobrautz, Werner; Dong, Sijia S.; Feng, Rulin; Ferre, Nicolas; Filatov (Gulak), Michael; Gagliardi, Laura; Garavelli, Marco; Gonzalez, Leticia; Guan, Yafu; Guo, Meiyuan; Hennefarth, Matthew R.; Hermes, Matthew R.; Hoyer, Chad E.; Huix-Rotllant, Miquel; Jaiswal, Vishal Kumar; Kaiser, Andy; Kaliakin, Danil S.; Khamesian, Marjan; King, Daniel S.; Kochetov, Vladislav; Krosnicki, Marek; Kumaar, Arpit Arun; Larsson, Ernst D.; Lehtola, Susi; Lepetit, Marie-Bernadette; Lischka, Hans; Rios, Pablo Lopez; Lundberg, Marcus; Ma, Dongxia; Mai, Sebastian; Marquetand, Philipp; Merritt, Isabella C. D.; Montorsi, Francesco; Morchen, Maximilian; Nenov, Artur; Vu Ha Anh Nguyen; Nishimoto, Yoshio; Oakley, Meagan S.; Olivucci, Massimo; Oppel, Markus; Padula, Daniele; Pandharkar, Riddhish; Quan Manh Phung; Plasser, Felix; Raggi, Gerardo; Rebolini, Elisa; Reiher, Markus; Rivalta, Ivan; Roca-Sanjuan, Daniel; Romig, Thies; Safari, Arta Anushirwan; Sanchez-Mansilla, Aitor; Sand, Andrew M.; Schapiro, Igor; Scott, Thais R.; Segarra-Marti, Javier; Segatta, Francesco; Sergentu, Dumitru-Claudiu; Sharma, Prachi; Shepard, Ron; Shu, Yinan; Staab, Jakob K.; Straatsma, Tjerk P.; Sorensen, Lasse Kragh; Tenorio, Bruno Nunes Cabral; Truhlar, Donald G.; Ungur, Liviu; Vacher, Morgane; Veryazov, Valera; Voss, Torben Arne; Weser, Oskar; Wu, Dihua; Yang, Xuchun; Yarkony, David; Zhou, Chen; Zobel, J. Patrick; Lindh, Roland Share Save
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Electron and ion spectroscopy of azobenzene in the valence and core shells Carlini, L.; Montorsi, F.; Wu, Y.; Bolognesi, P.; Borrego-Varillas, R.; Casavola, A. R.; Castrovilli, M. C.; Chiarinelli, J.; Mocci, D.; Vismarra, F.; Lucchini, M.; Nisoli, M.; Mukamel, S.; Garavelli, M.; Richter, R.; Nenov, A.; Avaldi, L. Share Save
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Environment-Driven Coherent Population Transfer Governs the Ultrafast Photophysics of Tryptophan Jaiswal, Vishal Kumar; Kabacinski, Piotr; de Faria, Barbara E. Nogueira; Gentile, Marziogiuseppe; de Paula, Ana Maria; Borrego-Varillas, Rocio; Nenov, Artur; Conti, Irene; Cerullo, Giulio; Garavelli, Marco Share Save
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Tracking excited state decay mechanisms of pyrimidine nucleosides in real time Borrego-Varillas, Rocio; Nenov, Artur; Kabacinski, Piotr; Conti, Irene; Ganzer, Lucia; Oriana, Aurelio; Jaiswal, Vishal Kumar; Delfino, Ines; Weingart, Oliver; Manzoni, Cristian; Rivalta, Ivan; Garavelli, Marco; Cerullo, Giulio Share Save
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In Silico Ultrafast Nonlinear Spectroscopy Meets Experiments: The Case of Perylene Bisimide Dye Segatta, 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 Share Save
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