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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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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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Modern quantum chemistry with [Open]Molcas Aquilante, Francesco; Autschbach, Jochen; Baiardi, Alberto; Battaglia, Stefano; Borin, Veniamin A.; Chibotaru, Liviu F.; Conti, Irene; De Vico, Luca; Delcey, Mickael; Galvan, Ignacio Fdez.; Ferre, Nicolas; Freitag, Leon; Garavelli, Marco; Gong, Xuejun; Knecht, Stefan; Larsson, Ernst D.; Lindh, Roland; Lundberg, Marcus; Malmqvist, Per Ake; Nenov, Artur; Norell, Jesper; Odelius, Michael; Olivucci, Massimo; Pedersen, Thomas B.; Pedraza-Gonzalez, Laura; Phung, Quan M.; Pierloot, Kristine; Reiher, Markus; Schapiro, Igor; Segarra-Marti, Javier; Segatta, Francesco; Seijo, Luis; Sen, Saumik; Sergentu, Dumitru-Claudiu; Stein, Christopher J.; Ungur, Liviu; Vacher, Morgane; Valentini, Alessio; Veryazov, Valera Share Save
Quantum coherence in complex environments: general discussion Alvertis, Antonios M.; Barford, William; Worster, Susannah Bourne; Burghardt, Irene; Datta, Animesh; Dijkstra, Arend; Fay, Thomas; Ghosh, Soumya; Gruenbaum, Tobias; Habershon, Scott; Hore, P. J.; Hutchinson, David; Iyengar, Srinivasan; Jones, Alex R.; Jones, Garth; Komarova, Ksenia; Lawrence, Joseph; Leonard, Jeremie; Litman, Yair; Mannouch, Jonathan; Manolopoulos, David; Martens, Craig; Mondelo-Martell, Manel; Picconi, David; Plant, Dave; Sakaushi, Ken; Saller, Maximilian A. C.; Schile, Addison; Scholes, Gregory D.; Segarra-Marti, Javier; Segatta, Francesco; Troisi, Alessandro; Worth, Graham Share Save
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Spectroscopic signatures of quantum effects: general discussion Alvertis, Antonios M.; Barford, William; Bourne Worster, Susannah; Burghardt, Irene; Chin, Alex; Datta, Animesh; Dijkstra, Arend; Fay, Thomas; Fielding, Helen; Gruenbaum, Tobias; Habershon, Scott; Hammes-Schiffer, Sharon; Iyengar, Srinivasan; Jones, Alex R.; Komarova, Ksenia; Leonard, Jeremie; Litman, Yair; Picconi, David; Plant, Dave; Schile, Addison; Scholes, Gregory D.; Segarra-Marti, Javier; Segatta, Francesco; Troisi, Alessandro; Worth, Graham Share Save
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