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Αποτελέσματα 41 έως 57 από 57 < προηγούμενο

Ημερομηνία	Τίτλος	Δημιουργός
2013	On the vibrational linear and nonlinear optical properties of compounds involving noble gas atoms: HXeOXeH, HXeOXeF, and FXeOXeF	Avramopoulos A.; Reis H.; Luis J.M.; Papadopoulos M.G.
2013	Theoretical modelling of photoswitching of hyperpolarisabilities in ruthenium complexes	Coe B.J.; Avramopoulos A.; Papadopoulos M.G.; Pierloot K.; Vancoillie S.; Reis H.
2014	Computation of nonlinear optical properties of molecules with large amplitude anharmonic motions. III. Arbitrary double-well potentials	Reis H.; Luis J.M.; Garcia-Borràs M.; Kirtman B.
2015	Reliable but timesaving: In search of an efficient quantum-chemical method for the description of functional fullerenes	Reis H.; Rasulev B.; Papadopoulos M.G.; Leszczynski J.
2016	Dipole and quadrupole polarizabilities of the water molecule as a function of geometry	Loboda O.; Ingrosso F.; Ruiz-López M.F.; Reis H.; Millot C.
2016	A series of novel derivatives with giant second hyperpolarizabilities, based on radiaannulenes, tetrathiafulvalene, nickel dithiolene, and their lithiated analogues	Avramopoulos A.; Reis H.; Otero N.; Karamanis P.; Pouchan C.; Papadopoulos M.G.
2017	Handbook of computational chemistry	Leszczynski J.; Kaczmarek-Kedziera A.; Puzyn T.; Papadopoulos M.G.; Reis H.; Shukla M.K.
2017	Preface of "Handbook of Computational Chemistry"	Leszczynski J.; Kaczmarek-Kedziera A.; Puzyn T.; Papadopoulos M.G.; Reis H.; Shukla M.K.
2017	Solvent effects on molecular electric properties	Medved’ M.; Budzák Š.; Bartkowiak W.; Reis H.
2018	Partitioning of interaction-induced nonlinear optical properties of molecular complexes. I. Hydrogen-bonded systems	Zaleśny R.; Medved M.; Góra R.W.; Reis H.; Luis J.M.
2019	Electric properties of hydrated uracil: From micro- to macrohydration	Hrivnák T.; Budzák Š.; Reis H.; Zaleśny R.; Carbonnière P.; Medveď M.
2020	A computational strategy for the design of photochromic derivatives based on diarylethene and nickel dithiolene with large contrast in nonlinear optical properties	Avramopoulos, Aggelos; Zaleśny, Robert; Reis, Heribert; Papadopoulos, Manthos G.
2020	Partitioning of interaction-induced nonlinear optical properties of molecular complexes. II. Halogen-bonded systems	Medved', Miroslav; Iglesias-Reguant, Alex; Reis, Heribert; Góra, Robert W.; Luis, Josep M.; Zaleśny, Robert
2020	Accurate nonlinear optical properties of solvated para-nitroaniline predicted by an electrostatic discrete local field approach	Hrivnák, Tomáš; Reis, Heribert; Neogrády, Pavel; Zaleśny, Robert; Medved', Miroslav
2022	Editorial: Computational Methods for the Description of Intermolecular Interactions and Molecular Motion in Confining Environments	Reis, Heribert; Żuchowski, Piotr; Grubisic, Sonja
2023	Decoding the infrared spectra changes upon formation of molecular complexes: the case of halogen bonding in pyridine⋯perfluorohaloarene complexes	Iglesias-Reguant, Alex; Reis, Heribert; Medved', Miroslav; Ośmiałowski, Borys; Zaleśny, Robert; Luis, Josep M
2024	One- and two-photon absorption spectra of organoboron complexes: vibronic and environmental effects	Petrusevich, Elizaveta F; Reis, Heribert; Ośmiałowski, Borys; Jacquemin, Denis; Luis, Josep M; Zaleśny, Robert

Αποτελέσματα 41 έως 57 από 57 < προηγούμενο