Výsledky vyhľadávania
Názov Mechanistic basis for red light switching of azonium lons Aut.údaje Miroslav Medveď ... [et al.] Autor Medveď Miroslav 1971- (13%) UMBFP08 - Katedra chémie
Spoluautori Di Donato Mariangela (13%)
Buma Wybren Jan (10%)
Laurent Adéle D. (10%)
Lameijer Lucien N. (5%)
Hrivnák Tomáš (7%)
Romanov Ivan (5%)
Tran Susannah (5%)
Feringa Ben L. (5%)
Szymanski Wiktor (10%)
Woolley G. Andrew (17%)
Zdroj.dok. Journal of the American Chemical Society. Vol. 145, no. 36 (2023), pp. 19894-19902. - Washington : The American Chemical Society, 2023 Kľúč.slová svetlo ióny chemické výpočty chemické zlúčeniny - chemical compounds Form.deskr. články - journal articles Jazyk dok. angličtina Krajina Spojené štáty URL Link na zdrojový dokument Kategória publikačnej činnosti ADC Číslo archívnej kópie 53514 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika 
článok
Názov Tailoring the optical and dynamic properties of iminothioindoxyl photoswitches through acidochromism Aut.údaje Miroslav Medved', Mark W. H. Hoorens ... [et al.] Autor Medveď Miroslav 1971- (10%) UMBFP08 - Katedra chémie
Spoluautori Hoorens Mark W. H. (10%)
Di Donato Mariangela (10%)
Laurent Adéle D. (10%)
Fan Jiayun (10%)
Taddei Maria (10%)
Hilbers Michiel (10%)
Feringa Ben L. (10%)
Buma Wybren Jan (10%)
Szymanski Wiktor (10%)
Zdroj.dok. Chemical Science. Vol. 12, no. 12 (2021), pp. 4588-4598. - Cambridge : Royal Society of Chemistry, 2021 Kľúč.slová nelineárne optické vlastnosti fotoprepínače - photoswitches Form.deskr. články - journal articles Jazyk dok. angličtina Krajina Veľká Británia URL Link na plný text Kategória publikačnej činnosti ADC Číslo archívnej kópie 51137 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika článok
Názov Iminothioindoxyl as a molecular photoswitch with 100 nm band separation in the visible range Aut.údaje Mark W. H. Hoorens ... [et al.] Autor Hoorens Mark W. H. (20%)
Spoluautori Medveď Miroslav 1971- (10%) UMBFP08 - Katedra chémie
Laurent Adéle D. (10%)
Di Donato Mariangela (10%)
Fanetti Samuele (5%)
Slappendel Laura (5%)
Hilbers (5%)
Feringa Ben L. (10%)
Buma Wybren Jan (10%)
Szymański Wiktor (15%)
Zdroj.dok. Nature Communications. Vol. 10, no. 2390 (2019), pp. 1-11. - London : Nature Research, 2019 Kľúč.slová molekulové fotoprepínače - molecular photoswitches teória funkcionálu hustoty chémia - chemistry prírodné vedy - natural sciences fotochemické reakcie - photochemical reactions Form.deskr. články - journal articles Jazyk dok. angličtina Krajina Veľká Británia Anotácia Light is an exceptional external stimulus for establishing precise control over the properties and functions of chemical and biological systems, which is enabled through the use of molecular photoswitches. Ideal photoswitches are operated with visible light only, show large separation of absorption bands and are functional in various solvents including water, posing an unmet challenge. Here we show a class of fully-visible-light-operated molecular photoswitches, lminothioindoxyls (ITIs) that meet these requirements. ITIs show a band separation of over 100 nm, isomerize on picosecond time scale and thermally relax on millisecond time scale. Using a combination of advanced spectroscopic and computational techniques, we provide the rationale for the switching behavior of ITIs and the influence of structural modifications and environment, including aqueous solution, on their photochemical properties. This research paves the way for the development of improved photo-controlled systems for a Kategória publikačnej činnosti ADC Číslo archívnej kópie 47137 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika 
nerozpoznaný
Názov Solvent effects on the actinic step of donor-acceptor stenhouse adduct photoswitching Aut.údaje Michael M. Lerch ... [et al.] Autor Lerch Michael M. (15%)
Spoluautori Di Donato Mariangela (15%)
Laurent Adéle D. (10%)
Medveď Miroslav 1971- (10%) UMBFP08 - Katedra chémie
Iagatti Alessandro (5%)
Bussotti Laura (5%)
Lapini Andrea (5%)
Buma Wybren Jan (10%)
Foggi Paolo (5%)
Szymański Wiktor (10%)
Feringa Ben L. (10%)
Zdroj.dok. Angewandte Chemie : international edition : a journal of the German Chemical Society. Vol. 57, no. 27 (2018), pp. 8063-8068. - Weinheim : Wiley-VCH, 2018 Kľúč.slová chémia - chemistry solvent effects density functional theory Form.deskr. články - journal articles Jazyk dok. angličtina Krajina Nemecko Systematika 54 URL Link na plný text Kategória publikačnej činnosti ADC Číslo archívnej kópie 44355 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika nerozpoznaný
Názov Tailoring photoisomerization pathways in donor-acceptor stenhouse adducts: The role of the hydroxy group Aut.údaje Michael M. Lerch, Miroslav Medveď ... [et al.] Autor Lerch Michael M. (10%)
Spoluautori Medveď Miroslav 1971- (10%) UMBFP08 - Katedra chémie
Lapini Andrea (10%)
Laurent Adéle D. (10%)
Iagatti Alessandro (5%)
Bussotti Laura (5%)
Szymański Wiktor (10%)
Buma Wybren Jan (10%)
Foggi Paolo (10%)
Di Donato Mariangela (10%)
Feringa Ben L. (10%)
Zdroj.dok. The Journal of Physical Chemistry A. Vol. 122, no. 4 (2018), pp. 955-964. - Washington : The American Chemical Society, 2018 Kľúč.slová chémia - chemistry density functional theory Form.deskr. články - journal articles Jazyk dok. angličtina Krajina Spojené štáty Systematika 54 URL https://pubs.acs.org/doi/abs/10.1021%2Facs.jpca.7b10255 Kategória publikačnej činnosti ADC Číslo archívnej kópie 44378 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika nerozpoznaný
Názov Exploring the solvatochromism of betaine 30 with ab initio tools Podnázov from accurate gas-phase calculations to implicit and explicit solvation models Aut.údaje Šimon Budzák ... [et al.] Autor Budzák Šimon 1982- (20%) UMBFP08 - Katedra chémie
Spoluautori Jaunet-Lahary Titouan (16%)
Laurent Adéle D. (16%)
Laurence Christian (16%)
Medveď Miroslav 1971- (16%) UMBFP08 - Katedra chémie
Jacquemin Denis (16%)
Zdroj.dok. Chemistry - A European Journal. Vol. 23, no. 17 (2017), pp. 4108-4119. - Weinheim : Wiley-VCH, 2017 Kľúč.slová solvatochromism solvatochromizmus betain 30 Jazyk dok. angličtina Krajina Nemecko Anotácia Betaine 30 is known for the extraordinary solvatochromism of its visible absorption band that goes from lambda=882 nm in tetrachloromethane to lambda=453 nm in water (Delta lambda=similar to 429nm). This large blueshift partly originates from a dramatic decrease of the dipole moment upon excitation. Despite several decades of research, experimental works still disagree on the exact value of the excess dipole moment, the orientation of the dipole moment of the excited-state, the role and amplitude of the change of the polarisability upon excitation as well as on the gas-phase excitation energy. In this work, we present an in-depth theoretical investigation. First, we carefully tested several levels of theory on the model system and next calculated the electric properties of betaine 30 at the CC2 level. Our best estimates are Delta mu = -7 D for the excess dipole moment, that is, a significant decrease but no change of direction, a Delta alpha value of -120 a. u. and a gas-phase vertical excitation energy of 1.127 eV. The implicit solvation models are able to reproduce the experimental trends, with large correlation coefficients for non-hydrogen-bond-donating solvents, the smallest rootmean-square deviation error being reached with the vertical excitation model (VEM). The explicit effective fragment potential method combined with time-dependent density functional theory (TD-DFT) in a QM/MM framework provides accurate estimates for hydrogen-bond-donating solvents, whereas the addition of a dispersion correction is needed to restore the correct solvatochromic direction in tetrachloromethane. Kategória publikačnej činnosti ADC Číslo archívnej kópie 41297 Kategória ohlasu BRANDAO, Idney - FRANCO, Leandro R. - FONSECA, Tertius L. - CASTRO, Marcos A. - GEORG, Herbert C. Confirming the relationship between first hyperpolarizability and the bond length alternation coordinate for merocyanine dyes. In Journal of chemical physics. ISSN 0021-9606, 2017, vol. 146, no. 22.
CATALAN, Javier - REICHARDT, Christian. Solvation by glycerol at temperatures from 353 to 77 K: its solvatochromic characterization and use to block the molecular structure of conformationally flexible structures. In Journal of physical chemistry A. ISSN 1089-5639, 2017, vol. 121, no. 38, pp. 7114-7120.
PRAMOD, A. G. - RENUKA, G. G. - SHIVASHANKAR, K. - BOREGOWDA, P. - NADAF, Y. F. Solvent influence on the photophysical properties of 4-(2-oxo-2H-benzo[h]chromen-4-ylmethoxy)-benzaldehyde. In AIP conference proceedings : 2nd international conference on condensed matter and applied physics, Bikaner, 24th-25th November 2017. Melville : American institute of physics, 2018. ISBN 978-0-7354-1648-2, pp. [1-4].
MERA-ADASME, Raul - DOMINGUEZ, Moises. A computationally-derived model for the solvatochromism of p-phenolates with high predictive power. In Physical chemistry chemical physics. ISSN 1463-9076, 2018, vol. 20, no. 26, pp. 18127-18132.
LI, Kai - SU, Xi - WANG, Yixuan - TAO, Furong - CUI, Yuezhi - ZHANG, Huayong - LI, Tianduo. D-pi-a type barbituric derivatives : aggregation induced emission, mechanofluorochromic and solvatochromic properties. In Journal of luminescence. ISSN 0022-2313, 2018, vol. 203, pp. 50-58.
MERA-ADASME, Raul - CAROLI REZENDE, Marcos - DOMINGUEZ, Moises. On the physical-chemical nature of solvent polarizability and dipolarity. In Spectrochimica acta. Part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2020, vol. 229, art. no. 118008, pp. 1-6.
Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika nerozpoznaný
Názov Shedding light on the photoisomerization pathway of donor-acceptor Stenhouse adducts Aut.údaje Mariangela Di Donato, Michael M. Lerch ... [et al.] Autor Di Donato Mariangela (15%)
Spoluautori Lerch Michael M. (15%)
Lapini Andrea (5%)
Laurent Adéle D. (10%)
Iagatti Alessandro (5%)
Bussotti Laura (5%)
Ihrig Svante P. (5%)
Medveď Miroslav 1971- (10%) UMBFP08 - Katedra chémie
Jacquemin Denis (5%)
Szymański Wiktor (5%)
Buma Wybren Jan (10%)
Foggi Paolo (5%)
Feringa Ben L. (5%)
Zdroj.dok. Journal of the American Chemical Society. Vol. 139, no. 44 (2017), pp. 15596-15599. - Washington : The American Chemical Society, 2017 Kľúč.slová molekulové fotoprepínače - molecular photoswitches donorno-akceptorové Stenhousove adukty ultra-fast spectroscopy DFT metóda Jazyk dok. angličtina Krajina Spojené štáty Systematika 54 Anotácia Donor-acceptor Stenhouse adducts (DASAs) are negative photochromes that hold great promise for a variety of applications. Key to optimizing their switching properties is a detailed understanding of the photoswitching mechanism, which, as yet, is absent. Here we characterize the actinic step of DASA-photoswitching and its key intermediate, which was studied using a combination of ultrafast visible and IR pump-probe spectroscopies and TD-DFT calculations. Comparison of the time-resolved IR spectra with DFT computations allowed to unambiguously identify the structure of the intermediate, confirming that light absorption induces a sequential reaction path in which a Z-E photoisomerization of C-2-C-3 is followed by a rotation around C-3-C-4 and a subsequent thermal cyclization step. First and second-generation DASAs share a common photoisomerization mechanism in chlorinated solvents with notable differences in kinetics and lifetimes of the excited states. The photogenerated intermediate of URL Link na plný text Kategória publikačnej činnosti ADC Číslo archívnej kópie 41477 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika nerozpoznaný
Názov Using time-dependent density functional theory to probe the nature of donor-acceptor stenhouse adduct photochromes Aut.údaje Adele D. Laurent, Miroslav Medveď, Denis Jaquemin Autor Laurent Adéle D. (30%)
Spoluautori Medveď Miroslav 1971- (30%) UMBFP08 - Katedra chémie
Jacquemin Denis (40%)
Zdroj.dok. ChemPhysChem. Vol. 17, no. 12, special issue (2016), pp. 1846-1851. - Weinheim : Wiley-VCH, 2016 Kľúč.slová fotoprepínače - photoswitches UV spektrá Jazyk dok. angličtina Krajina Nemecko Systematika 54 58 Kategória publikačnej činnosti ADC Číslo archívnej kópie 37634 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika nerozpoznaný
Názov Tuning ESIPT fluorophores into dual emitters Aut.údaje Cloé Azarias ... [et al.] Autor Azarias Cloe (20%)
Spoluautori Budzák Šimon 1982- (20%) UMBFP08 - Katedra chémie
Laurent Adéle D. (20%)
Ulrich Gilles (20%)
Jacquemin Denis (20%)
Zdroj.dok. Chemical Science. Vol. 7, no. 6 (2016), pp. 3763-3774. - Cambridge : Royal Society of Chemistry, 2016 Kľúč.slová ESIPT fluorophores UV/vis and fluorescence spectroscopy TD-DFT ESIPT fluorofory fluorescencia Jazyk dok. angličtina Krajina Veľká Británia Systematika 54 Kategória publikačnej činnosti ADC Číslo archívnej kópie 37294 Kategória ohlasu HUANG, Quan - GUO, Qiang - LAN, Jingbo - YOU, Jingsong. Tuning the dual emission of keto/enol forms of excited-state intramolecular proton transfer (ESIPT) emitters via intramolecular charge transfer (ICT). In Dyes and pigments. ISSN 0143-7208, 2021, vol. 193, art. no. 109497, pp. 1-10.
DING, Sha - XU, Aixiang - SUN, Aokui - XIA, Yong - LIU, Yuejun. Substituent effect on ESIPT and hydrogen bond mechanism of N-(8-quinolyl) salicylaldimine : a detailed theoretical exploration. In Spectrochimica acta. Part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2021, vol. 245, art. no. 118937, pp. 1-7.
EBINA, Masanori - KONDO, Yusuke - IWASA, Takeshi - TAKETSUGU, Tetsuya. Low-lying excited states of hqxcH and Zn-hqxc complex : toward understanding intramolecular proton transfer emission. In Inorganic chemistry. ISSN 0020-1669, 2019, vol. 58, no. 7, pp. 4686-4698.
HILL, Nicholas S. - COOTE, Michelle L. A comparison of methods for theoretical photochemistry : applications, successes and challenges. In Annual reports in computational chemistry. Amsterdam : Elsevier, 2019. Vol. 15. ISBN 978-0-12-817120-2, pp. 203-285.
YIN, Hang - ZHANG, Yu-Mo - ZHAO, Hui-Fang - YANG, GuoJian - SHI, Ying - ZHANG, Sean Xiao-An - DING, Da-Jun. Optical anti-counterfeiting of a single molecule by two solvents based on intra- and intermocular excited state proton transfer mechanisms. In Dyes and pigments. ISSN 0143-7208, 2018, vol. 159, pp. 506-512.
MEISNER, Quinton J. - YOUNES, Ali H. - YUAN, Zhao - SREENATH, Kesavapillai - HURLEY, Joseph J. M. - ZHU, Lei. Excitation-dependent multiple fluorescence of a substituted 2-(2 '-hydroxyphenyl)benzoxazole. In Journal of physical chemistry A. ISSN 1089-5639, 2018, vol. 122, no. 47, pp. 9209-9223.
ZHOU, Panwang - ZHAO, Li. Accurate description of excited state intramolecular proton transfer that involves zwitterionic state using optimally tuned range-separated time-dependent density functional theory. In International journal of quantum chemistry. ISSN 0020-7608, 2018, vol. 118, no. 15, pp. 1-10.
GAYATHRI, Parthasarathy - PANNIPARA, Mehboobali - AL-SEHEMI, Abdullah G. - ANTHONY, Savarimuthu Philip. Recent advances in excited state intramolecular proton transfer mechanism-based solid state fluorescent materials and stimuli-responsive fluorescence switching. In CrystEngComm. ISSN 1466-8033, 2021, vol. 23, no. 21, pp. 3771-3789.
TOGASAKI, Kei - ARAI, Tatsuo - NISHIMURA, Yoshinobu. Opposite substituent effects in the ground and excited states on the acidity of N-H fragments involved in proton transfer reaction in aromatic urea compounds. In Photochemical and photobiological sciences. ISSN 1474-905X, 2021, vol. 20, no. 4, pp. 523-532.
SHIGEMITSU, Yasuhiro - MURAMATSU, Tatsuya - MUTAI, Toshiki. Computational investigation on ESIPT-driven luminescence of imidazo [1,2-a]pyridine derivatives regulated by inter/intramolecular hydrogen bonding. In Journal of photochemistry and photobiology A : chemistry. ISSN 1010-6030, 2021, vol. 409, art. no. 113140, pp. 1-9.
DONG, Hao - YANG, Huan - ZHAO, Jinfeng - LIU, Xiaoyan - ZHENG, Yujun. Modulation of excited state proton transfer. In Journal of luminescence. ISSN 0022-2313, 2021, vol. 231, art. no. 117840, pp. 1-7.
KERDPOL, Khanittha - DAENGNGERN, Rathawat - SATTAYANON, Chanchai - NAMUANGRUK, Supawadee - RUNGROTMONGKOL, Thanyada - WOLSCHANN, Peter - KUNGWAN, Nawee - HANNONGBUA, Supot. Effect of water microsolvation on the excited-state proton transfer of 3-hydroxyflavone enclosed in gamma-cyclodextrin. In Molecules. ISSN 1420-3049, 2021, vol. 26, no. 4, pp. 1-14.
KUKHTA, Nadzeya A. - BRYCE, Martin R. Dual emission in purely organic materials for optoelectronic applications. In Materials horizons. ISSN 2051-6347, 2021, vol. 8, no. 1, pp. 33-55.
MENA, Leandro D. - VERA, D. M. A. - BAUMGARTNER, Maria T. Impact of benzannulation on ESIPT in 2-(2 '-hydroxyphenyl)-oxazoles : a unified perspective in terms of excited-state aromaticity and intramolecular charge transfer. In RSC advances. ISSN 2046-2069, 2020, vol. 10, no. 64, pp. 39049-39059.
MORAES, Emmanuel Santos - ALVES DUARTE, Luis Gustavo Teixeira - GERMINO, Jose Carlos - ZAMBON ATVARS, Teresa Dib. Near attack conformation as strategy for ESIPT modulation for white-light generation. In Journal of physical chemistry C. ISSN 1932-7447, 2020, vol. 124, no. 41, pp. 22406-22415.
KUMAR, Gulshan - PAUL, Kamaldeep - LUXAMI, Vijay. Deciphering the excited state intramolecular charge-coupled double proton transfer in an asymmetric quinoline-benzimidazole system. In New journal of chemistry. ISSN 1144-0546, 2020, vol. 44, no. 29, pp. 12866-12874.
ANAND, Neethu - NAG, Probal - KANAPARTHI, Ravi Kumar - VENNAPUSA, Sivaranjana Reddy. O-H vibrational motions promote sub-50 fs nonadiabatic dynamics in 3-hydroxypyran-4-one : interplay between internal conversion and ESIPT. In Physical chemistry chemical physics. ISSN 1463-9076, 2020, vol. 22, no. 16, pp. 8745-8756.
NI, Mei - SU, Shenyang - FANG, Hua. Substituent control of photophysical properties for excited-state intramolecular proton transfer (ESIPT) of o-LHBDI derivatives : a TD-DFT investigation. In Journal of molecular modeling. ISSN 1610-2940, 2020, vol. 26, no. 5, pp. [1-10].
ZHANG, Nuonuo - LIU, Genjiang - YAN, Jiaying - ZHANG, Tingting - LIU, Xiang. Naked diazaborepin dyes : synthesis, photophysical properties, substituent effects and theoretical calculations on ESIPT process. In Dyes and pigments. ISSN 0143-7208, 2020, vol. 175, art. no. 108128, pp. 1-7.
TANG, Zhe - WEI, Haiwen - ZHOU, Panwang. Effects of solvents on the excited state intramolecular proton transfer and hydrogen bond mechanisms of alizarin and its isomers. In Journal of molecular liquids. ISSN 0167-7322, 2020, vol. 301, art. no. 112415, pp. 1-10.
WATWIANGKHAM, Athis - ROONGCHAROEN, Thantip - KUNGWAN, Nawee. Effect of nitrogen substitution and pi-conjugation on photophysical properties and excited state intramolecular proton transfer reactions of methyl salicylate derivatives : theoretical investigation. In Journal of photochemistry and photobiology A : chemistry. ISSN 1010-6030, 2020, vol. 389, art. no. 112267, pp. 1-11.
MISHRA, Virendra R. - GHANAVATKAR, Chaitannya W. - SEKAR, Nagaiyan. Towards NIR-active hydroxybenzazole (HBX)-based ESIPT motifs : a recent research trend. In ChemistrySelect. ISSN 2365-6549, 2020, vol. 5, no. 6, pp. 2103-2113.
ZHANG, Nuonuo - ZHANG, Tingting - WEN, Liu - WANG, Long - YAN, Jiaying - ZHENG, Kaibo. Tuning the excited-state intramolecular proton transfer (ESIPT) process of indole-pyrrole systems by pi-conjugation and substitution effects : experimental and computational studies. In Physical chemistry chemical physics. ISSN 1463-9076, 2020, vol. 22, no. 3, pp. 1409-1415.
LI, Chaozheng - HU, Bo - LIU, Yufang. Unraveling the effect of two different polar solvents on the excited-state intramolecular proton transfer of 4 '-methoxy-3-hydroxyflavone fluorescent dye. In Spectrochimica acta. Part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2020, vol. 225, art. no. 117487, pp. 1-7.
NI, Mei - SU, Shenyang - FANG, Hua. Excited state intramolecular proton transfer via different size of hydrogen bond ring : a theoretical insight. In Theoretical chemistry accounts. ISSN 1432-881X, 2019, vol. 138, no. 12, pp. [1-8].
MISHRA, Virendra R. - GHANAVATKAR, Chaitannya W. - SEKAR, Nagaiyan. ESIPT clubbed azo dyes as deep red emitting fluorescent molecular rotors : photophysical properties, pH study, viscosity sensitivity, and DFT studies. In Journal of luminescence. ISSN 0022-2313, 2019, vol. 215, art. no. 116689, pp. 1-9.
KUZU, Burak - TAN, Meltem - EKMEKCI, Zeynep - MENGES, Nurettin. A novel structure for ESIPT emission : experimental and theoretical investigations. In Journal of photochemistry and photobiology A : chemistry. ISSN 1010-6030, 2019, vol. 381, art. no. 111874, pp. 1-7.
KHANRA, Somnath - TA, Sabyasachi - GHOSH, Milan - CHATTERJEE, Sudeshna - DAS, Debasis. Subtle structural variation in azine/imine derivatives controls Zn2+ sensitivity : ESIPT-CHEF combination for nano-molar detection of Zn2+ with DFT support. In RSC advances. ISSN 2046-2069, 2019, vol. 9, no. 37, pp. 21302-21310.
HONG, Dan-Li - LUO, Yang-Hui - HE, Xiao-Tong - ZHENG, Zi-Yue - SU, Shan - WANG, Jia-Ying - WANG, Cong - CHEN, Chen - SUN, Bai-Wang. Unraveling the mechanisms of the excited-state intermolecular proton transfer (ESPT) for a D-pi-a molecular architecture. In Chemistry : a European journal. ISSN 0947-6539, 2019, vol. 25, no. 37, pp. 8805-8812.
BHOL, Mamina - PRIYATHARSINI, Maruthupandiyan - KRISHNAKUMAR, Rajaputi Venkatraman - SATHIYENDIRAN, Malaichamy. Solid state structure and photophysical properties of monoanionic 2-(2 '-hydroxyphenyl)benzimidazole as an anionic core in rhenium complex. In Journal of organometallic chemistry. ISSN 0022-328X, 2019, vol. 889, pp. 27-32.
MENA, Leandro D. - VERA, D. M. A. - BAUMGARTNER, Maria T. - JIMENEZ, Liliana B. Adiabatic deprotonation as an important competing pathway to ESIPT in photoacidic 2-phenylphenols. In Physical chemistry chemical physics. ISSN 1463-9076, 2019, vol. 21, no. 23, pp. 12231-12240.
LAMPKIN, Bryan J. - NGUYEN, Yen H. - KARADAKOV, Peter B. - VANVELLER, Brett. Demonstration of Baird's rule complementarity in the singlet state with implications for excited-state intramolecular proton transfer. In Physical chemistry chemical physics. ISSN 1463-9076, 2019, vol. 21, no. 22, pp. 11608-11614.
YUAN, Huijuan - GUO, Xugeng - ZHANG, Jinglai. Ab initio insights into the mechanism of excited-state intramolecular proton transfer triggered by the second excited singlet state of a fluorescent dye : an anti-Kasha behavior. In Materials chemistry frontiers. ISSN 2052-1537, 2019, vol. 3, no. 6, pp. 1225-1230.
SATAPATHY, Ashok K. - BEHERA, Santosh K. - YADAV, Ankit - MAHOUR, Laxmi Narayan - YELAMAGGAD, C. - SANDHYA, K. L. - SAHOO, Balaram. Tuning the fluorescence behavior of liquid crystal molecules containing Schiff-base : effect of solvent polarity. In Journal of luminescence. ISSN 0022-2313, 2019, vol. 210, pp. 371-375.
XIA, Shu-Hua - CHE, Meng - LIU, Yan - ZHANG, Yan - CUI, Ganglong. Photochemical mechanism of 1,5-benzodiazepin-2-one : electronic structure calculations and nonadiabatic surface-hopping dynamics simulations. In Physical chemistry chemical physics. ISSN 1463-9076, 2019, vol. 21, no. 19, pp. 10086-10094.
LIU, Deming - DING, Qiuping - FU, Yang - SONG, Zhibin - PENG, Yiyuan. Rh-catalyzed C-H amidation of 2-arylbenzo[d]thiazoles : an approach to single organic molecule white light emitters in the solid state. In Organic letters. ISSN 1523-7060, 2019, vol. 21, no. 8, pp. 2523-2527.
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Názov Solvatochromic shifts in UV-Vis absorption spectra: the challenging case of 4‑nitropyridine N‑oxide Aut.údaje Šimon Budzák ... [et al.] Autor Budzák Šimon 1982- (30%)
Spoluautori Laurent Adéle D. (15%)
Laurence Christian (15%)
Medveď Miroslav 1971- (15%) UMBFP08 - Katedra chémie
Jacquemin Denis (25%)
Zdroj.dok. Journal of Chemical Theory and Computation. Vol. 12, no. 4 (2016), pp. 1919-1929. - Washington : The American Chemical Society, 2016 Kľúč.slová adsorpčné spektrá - adsorption spectra solvatochromické posuny - solvatochromic shifts Jazyk dok. angličtina Krajina Spojené štáty Systematika 54 Kategória publikačnej činnosti ADC Číslo archívnej kópie 37635 Kategória ohlasu RAMLI, Mariam Fadzlina - LIM, Wen Huei - ISHAK, Izwan - SU'AIT, Mohd Sukor - GAN, Seng Neon - PHANG, Sook-Wai. Adhesion improvement of polyaniline counter electrode in dye-sensitized solar cell using bio-based alkyd. In Applied physics a-materials science & processing. ISSN 0947-8396, 2021, vol. 127, no. 5, pp. [1-9].
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