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S

Stefano Battaglia

university of zurich

19H指数
97论文数
1.8K被引数
收录论文 19
发表时间
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QCMaquis 4.0: Multipurpose Electronic; Vibrational; and Vibronic Structure and Dynamics Calculations with the Density Matrix Renormalization GroupQCMaquis 4.0：多功能电子、振动及电子-振动结构动力学计算与密度矩阵重整化群方法
errThe Journal of Physical Chemistry A
IF0
err2025-08-01
err0
errOAAI
errKalman Szenes; Nina Glaser; Mihael Erakovic; Valentin Barandun; Maximilian Mörchen; Robin Feldmann; Stefano Battaglia; Alberto Baiardi; Markus Reiher
err分享
err收藏
Extensive Band Gap Tunability in Covalent Organic Frameworks via Metal Intercalation and High Pressure通过金属插层和高压力实现共价有机框架的宽带隙可调性
errphysical chemistry letters
IF0
err2025-07-15
err0
errOAAI
errMichelle Ernst; Jürg Hutter; Stefano Battaglia
err分享
err收藏
A general framework for active space embedding methods with applications in quantum computing
errNPJ COMPUTATIONAL MATERIALS
IF11.9
err2024-12-19
err0
errOAAI
errBattaglia, Stefano; Rossmannek, Max; Rybkin, Vladimir V.; Tavernelli, Ivano; Hutter, Jurg
err分享
err收藏
The OpenMolcas Web: A Community-Driven Approach to Advancing Computational ChemistryOpenMolcas Web: 一种社区驱动的推进计算化学的方法
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-05-22
err127
errOAAI
errManni, 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
err分享
err收藏
Regularized CASPT2: an Intruder-State-Free Approach
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-07-25
err29
errOAAI
errBattaglia, Stefano; Fransen, Lina; Galvan, Ignacio Fdez.; Lindh, Roland
err分享
err收藏
Analytic First-Order Derivatives of (X)MS, XDW, and RMS Variants of the CASPT2 and RASPT2 Methods
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-06-14
err33
errOAAI
errNishimoto, Yoshio; Battaglia, Stefano; Lindh, Roland
err分享
err收藏
On the role of symmetry in XDW-CASPT2
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-01-15
err28
errOAAI
errBattaglia, Stefano; Lindh, Roland
err分享
err收藏
P,N-Chelated Gold(III) Complexes: Structure and Reactivity
errINORGANIC CHEMISTRY
IF4.7
err2020-11-10
err13
errOAAI
errReiersolmoen, Ann Christin; Battaglia, Stefano; Orthaber, Andreas; Lindh, Roland; Erdelyi, Mate; Fiksdahl, Anne
err分享
err收藏
Modern quantum chemistry with [Open]Molcas现代量子化学与 [开] Molcas
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-06-05
err355
errOAAI
errAquilante, 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
err分享
err收藏
Extended Dynamically Weighted CASPT2: The Best of Two Worlds
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2020-02-06
err59
errOAAI
errBattaglia, Stefano; Lindh, Roland
err分享
err收藏
Symmetry of three-center, four-electron bonds
errCHEMICAL SCIENCE
IF7.4
err2020-01-01
err37
errOAAI
errReiersolmoen, Ann Christin; Battaglia, Stefano; Oien-Odegaard, Sigurd; Gupta, Arvind Kumar; Fiksdahl, Anne; Lindh, Roland; Erdelyi, Mate
err分享
err收藏
A simple position operator for periodic systems
errPHYSICAL REVIEW B
IF3.7
err2019-05-24
err22
errOAAI
errde Aragaoo, Emilia Valenca Ferreira; Moreno, Diego; Battaglia, Stefano; Bendazzoli, Gian Luigi; Evangelisti, Stefano; Leininger, Thierry; Suaud, Nicolas; Berger, J. A.
err分享
err收藏
Signatures of Wigner localization in one-dimensional systems
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2018-03-22
err21
errOAAI
errDiaz-Marquez, Alejandro; Battaglia, Stefano; Bendazzoli, Gian Luigi; Evangelisti, Stefano; Leininger, Thierry; Berger, J. A.
err分享
err收藏
Efficient Relativistic Density-Matrix Renormalization Group Implementation in a Matrix-Product Formulation
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2018-03-20
err42
errOAAI
errBattaglia, Stefano; Keller, Sebastian; Knecht, Stefan
err分享
err收藏
Structural boron as factor controlling illite crystallinity in a mud volcano environment (Northern Apennine, Italy)
errCHEMICAL GEOLOGY
IF3.6
err2016-12-01
err5
PREAI
errBattaglia, Stefano; Pennisi, Maddalena
err分享
err收藏
Dynamic evolution of badlands in the Roglio basin (Tuscany, Italy)
errCATENA
IF5.7
err2011-07-01
err22
PREAI
errBattaglia, S.; Leoni, L.; Rapetti, F.; Spagnolo, M.
err分享
err收藏
Mineralogical and grain size composition of clays developing calanchi and biancane erosional landforms
errGEOMORPHOLOGY
IF3.3
err2003-01-01
err61
PREAI
errBattaglia, S; Leoni, L; Sartori, F
err分享
err收藏
Hydrothermal alteration in the Aluto-Langano geothermal field, Ethiopia
errGEOTHERMICS
IF3.9
err1996-12-01
err59
PREAI
errTeklemariam, M; Battaglia, S; Gianelli, G; Ruggieri, G
err分享
err收藏
Surface phases analysis by grazing incidence of X-rays in a Bragg-Brentano diffractometer
errAPPLIED SURFACE SCIENCE
IF6.9
err1996-04-01
err8
PREAI
errBattaglia, S
err分享
err收藏

研究方向

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