Agisilaos Chantzis
机构: Computational Chemist at GTN LTD
每年引用次数
引用次数
引用: 667
H-指数: 13
I10-指数 : 14
出版物: 18
Interaction-induced electric properties in Kr-Ne from ab initio and DFT calculations. Is there a discrepancy between theory and experiment for the dipole moment?
Agesilaos Chantzis , George Maroulis
Chemical Physics Letters 507 ( 1) 42 -47
16
2011
Electric multipole moments of substituted acetylenic chains Η-(C≡C)n-H, X-(C≡C)n-H and Χ-(C≡C)n-X, electric (hyper)polarizability of acetylenic chains Η-(C≡C)n-H and their interaction induced electric properties with helium atoms H-(C≡C)n-H…He
A Chantzis
University of Patras
2011
Boron difluorides with formazanate ligands: redox-switchable fluorescent dyes with large stokes shifts
M-C Chang , A Chantzis , D Jacquemin , E Otten
Dalton Transactions 45 ( 23) 9477 -9484
57
2016
A database of Gaussian-type basis sets applied to the calculation of electric properties of the azide anion
G Maroulis , A Hantzis , A Haskopoulos
ICCMSE 2004 Conference Proceedings 1 1081 -1084
2004
Benzothiophene or benzofuran bridges in diaryl ethenes: two-step access by pd-catalyzed C-H activation and theoretical/experimental studies on their photoreactivity.
Kedong Yuan , Julien Boixel , Agisilaos Chantzis , Denis Jacquemin
Chemistry: A European Journal 20 ( 32) 10073 -10083
7
2014
Solvatomagnetic Comparison Method: A Proper Quantification of Solvent Hydrogen-Bond Basicity.
Christian Laurence , Julien Legros , Pierre Nicolet , Daniela Vuluga
Journal of Physical Chemistry B 118 ( 27) 7594 -7608
16
2014
Theoretical evidence of photo-induced charge transfer from DNA to intercalated ruthenium (II) organometallic complexes
Agisilaos Chantzis , Thibaut Very , Chantal Daniel , Antonio Monari
Chemical Physics Letters 578 133 -137
47
2013
Improved Treatment of Surrounding Effects: UV/vis Absorption Properties of a Solvated Ru(II) Complex
Agisilaos Chantzis , Thibaut Very , Antonio Monari , Xavier Assfeld
Journal of Chemical Theory and Computation 8 ( 5) 1536 -1541
41
2012
Is the Tamm-Dancoff Approximation Reliable for the Calculation of Absorption and Fluorescence Band Shapes?
Agisilaos Chantzis , Adèle D. Laurent , Carlo Adamo , Denis Jacquemin
Journal of Chemical Theory and Computation 9 ( 10) 4517 -4525
45
2013
Optical Properties of Diarylethenes with TD-DFT: 0-0 Energies, Fluorescence, Stokes Shifts, and Vibronic Shapes.
Agisilaos Chantzis , Javier Cerezo , Aurélie Perrier , Fabrizio Santoro
Journal of Chemical Theory and Computation 10 ( 9) 3944 -3957
17
2014
Ab Initio Wave Function-Based Determination of Element Specific Shifts for the Efficient Calculation of X-ray Absorption Spectra of Main Group Elements and First Row Transition Metals
Agisilaos Chantzis , Joanna K. Kowalska , Dimitrios Maganas , Serena DeBeer
Journal of Chemical Theory and Computation 14 ( 7) 3686 -3702
22
2018
Sequential double second-order nonlinear optical switch by an acido-triggered photochromic cyclometallated platinum(II) complex.
Julien Boixel , Véronique Guerchais , Hubert Le Bozec , Agisilaos Chantzis
Chemical Communications 51 ( 37) 7805 -7808
59
2015
A database of dispersion-induction DI, electrostatic ES, and hydrogen bonding α1 and β1 solvent parameters and some applications to the multiparameter correlation analysis of solvent effects.
Christian Laurence , Julien Legros , Agisilaos Chantzis , Aurélien Planchat
Journal of Physical Chemistry B 119 ( 7) 3174 -3184
65
2015
Designing Efficient Azobenzene and Azothiophene Nonlinear Optical Photochromes
Titouan Jaunet-Lahary , Agisilaos Chantzis , Kathy J. Chen , Adèle D. Laurent
Journal of Physical Chemistry C 118 ( 49) 28831 -28841
25
2014
UV--vis absorption spectrum of a novel Ru (II) complex intercalated in DNA:[Ru (2, 2′-bipy)(dppz)(2, 2′-ArPy)]+
Agisilaos Chantzis , Thibaut Very , Stéphane Despax , Jean-Thomas Issenhuth
Journal of molecular modeling 20 1 -10
19
2014
Boron difluorides with formazanate ligands: redox-switchable fluorescent dyes with large stokes shifts
M-C Chang , A Chantzis , D Jacquemin , E Otten
Dalton Transactions 45 ( 23) 9477 -9484
57
2016
Comparison of high-level post-Hartree–Fock and DFT methods on the calculation of interaction-induced electric properties of Kr–He
Demetrios Xenides , Agesilaos Hantzis , George Maroulis
Chemical Physics 382 ( 1-3) 80 -87
25
2011
Electric properties of the azide ion calculated with a systematic sequence of Gaussian-type basis sets
George Maroulis , Agesilaos Hatzis , Anastasios Haskopoulos
Chemical Physics 323 ( 2) 451 -457
7
2006