Výsledky vyhľadávania
Názov The Journal of Physical Chemistry B Vyd.údaje Washington : The American Chemical Society , 2020 ISSN 1520-61061520-5207 Form.deskr. časopisy - journals Roč., číslo Vol. 124 no. 45 (2020) Jazyk dok. angličtina Krajina Spojené štáty URL Link na zdrojový dokument Kategória publikačnej činnosti GII Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy - PERIODIKÁ - Súborný záznam periodika (1) - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika ČLÁNKY 2020: Accurate nonlinear optical properties of solvated para-nitroaniline predicted by an electrostatic discrete local field approach 
časopis
Názov Accurate nonlinear optical properties of solvated para-nitroaniline predicted by an electrostatic discrete local field approach Aut.údaje Tomáš Hrivnák, Heribert Reis ... [et al.] Autor Hrivnák Tomáš (35%)
Spoluautori Reis Heribert (25%)
Neogrády Pavel (10%)
Zaleśny Robert 1977- (10%)
Medveď Miroslav 1971- (20%) UMBFP08 - Katedra chémie
Zdroj.dok. The Journal of Physical Chemistry B. Vol. 124, no 45 (2020), pp. 10195-10209. - Washington : The American Chemical Society, 2020 Kľúč.slová nonlinear optical properties electrostatic field new approaches Form.deskr. články - journal articles Jazyk dok. angličtina Krajina Spojené štáty URL Link na plný text Kategória publikačnej činnosti ADC Číslo archívnej kópie 48874 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika 
článok
Názov The Journal of Physical Chemistry B Vyd.údaje Washington : The American Chemical Society , 2016 ISSN 1520-61061520-5207 Form.deskr. časopisy - journals Roč., číslo Vol. 120 no. 27 (2016) Jazyk dok. angličtina Krajina Spojené štáty URL Link na zdrojový dokument Kategória publikačnej činnosti GII Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy - PERIODIKÁ - Súborný záznam periodika (1) - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika ČLÁNKY 2016: Mechanism of fluorescence switching in one ESIPT-based Al3+ probe časopis
Názov The Journal of Physical Chemistry B Vyd.údaje Washington : The American Chemical Society , 2016 ISSN 1520-61061520-5207 Form.deskr. časopisy - journals Roč., číslo Vol. 120 no. 9 (2016) Jazyk dok. angličtina Krajina Spojené štáty URL Link na zdrojový dokument Kategória publikačnej činnosti GII Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy - PERIODIKÁ - Súborný záznam periodika (1) - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika ČLÁNKY 2016: First-principles simulations of one-and two-photon absorption band shapes of the bis core complex časopis
Názov Mechanism of fluorescence switching in one ESIPT- based Al3+ probe Aut.údaje Šimon Budzák, Denis Jacquemin Autor Budzák Šimon 1982- (50%) UMBFP08 - Katedra chémie
Spoluautori Jacquemin Denis (50%)
Zdroj.dok. The Journal of Physical Chemistry B. Vol. 120, no. 27 (2016), pp. 6730-6738. - Washington : The American Chemical Society, 2016 Kľúč.slová ESIPT fluorofory UV/vis and fluorescence spectroscopy TD-DFT fluorescencia Jazyk dok. angličtina Krajina Spojené štáty Systematika 54 Kategória publikačnej činnosti ADC Číslo archívnej kópie 37295 Kategória ohlasu CZERNEL, Grzegorz - BUDZIAK, Iwona - ONISZCZUK, Anna - KARCZ, Dariusz - PUSTULA, Katarzyna - GORECKI, Andrzej - MATWIJCZUK, Alicja - GLADYSZEWSKA, Bozena - GAGOS, Mariusz - NIEWIADOMY, Andrzej - MATWIJCZUK, Arkadiusz. ESIPT-related origin of dual fluorescence in the selected model 1,3,4-thiadiazole derivatives. In Molecules. ISSN 1420-3049, 2020, vol. 25, no. 18, pp. 1-22.
MATHIVANAN, Moorthy - THARMALINGAM, Balamurugan - DEVARAJ, Thangaraj - MURUGAN, Abinayaselvi - LIN, Chia-Her - JOTHI, Mathivanan - MURUGESAPANDIAN, Balasubramanian. A new 7-diethylamino-4-hydroxycoumarin based reversible colorimetric/fluorometric probe for sequential detection of Al3+/PPi and its potential use in biodetection and bioimaging applications. In New journal of chemistry. ISSN 1144-0546, 2021, vol. 45, no. 13, pp. 6067-6079.
DAS, Bhriguram - DOLAI, Malay - DHARA, Anamika - GHOSH, Avijit - MABHAI, Subhabrata - MISRA, Ajay - DEY, Satyajit - JANA, Atanu. Solvent-regulated fluorimetric differentiation of Al3+ and Zn2+ using an AIE-active single sensor. In Journal of physical chemistry A. ISSN 1089-5639, 2021, vol. 125, no. 7, pp. 1490-1504.
YANG, Yunfan - SHI, Wei - CHEN, Yunpeng - MA, Fengcai - LI, Yongqing. The direct evidence for ESPT route and ICT emission of N6-Methyladenine in aqueous solution. In Journal of luminescence. ISSN 0022-2313, 2021, vol. 229, art. no. 117698, pp. 1-9.
AYDIN, Duygu. Sensing of aluminum and cyanide ions utilizing a novel bis-phenol a based fluorogenic probe : applications in test stripts. In Microchemical journal. ISSN 0026-265X, 2020, vol. 159, art. no. 105477, pp. 1-10.
AYDIN, Duygu. A novel turn on fluorescent probe for the determination of Al3+ and Zn2+ ions and its cells applications. In Talanta. ISSN 0039-9140, 2020, vol. 210, art. no. 120615, pp. 1-7.
TIAN, Xue-Mei - YAO, Shu-Li - QIU, Cheng-Qiang - ZHENG, Teng-Fei - CHEN, Yong-Qiang - HUANG, Haiping - CHEN, Jing-Lin - LIU, Sui-Jun - WEN, He-Rui. Turn-on luminescent sensor toward Fe3+, Cr3+, and Al3+ based on a Co(II) metal-organic framework with open functional sites. In Inorganic chemistry. ISSN 0020-1669, 2020, vol. 59, no. 5, pp. 2803-2810.
LI, Zheng - WANG, Qian - WANG, Jing - JING, Xuemin - WANG, Shujun - XIAO, Liwei - LIA, Lele. A fluorescent light-up probe for selective detection of Al3+ and its application in living cell imaging. In Inorganica chimica acta. ISSN 0020-1693, 2020, vol. 500, art. no. 119231, pp. 1-5.
ZHU, Yilin - GONG, Xiangshuo - LI, Zhipeng - ZHAO, Xun - LIU, Zhiqiang - CAO, Duxia - GUAN, Ruifang. A simple turn-on ESIPT and PET-based fluorescent probe for detection of Al3+ in real-water sample. In Spectrochimica acta. Part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2019, vol. 219, pp. 202-205.
WANG, Man - CHENG, Caiqi - LI, Chunbo - WU, Dehua - SONG, Jintong - WANG, Jun - ZHOU, Xiangge - XIANG, Haifeng - LIU, Jin. Smart, chiral, and nonconjugated cyclohexane-based bis-salicylaldehyde hydrazides: multi-stimuli-responsive, turn-on, ratiometric, and thermochromic fluorescence, single-crystal structures via DFT calculations. In Journal of materials chemistry C. ISSN 2050-7526, 2019, vol. 7, no. 22, pp. 6767-6778.
AVADANEI, Mihaela - PINA, Joao - SERPA, Carlos - TIGOIANU, Radu - COZAN, Vasile. Photochromic cycle of two N-salicylidene-p-X-anilines revealed by the dynamics over 10 orders of magnitude. In Journal of molecular liquids. ISSN 0167-7322, 2019, vol. 283, pp. 617-629.
SUN, Jiayi - ZHANG, Min - SUN, Changyan. A highly selective fluorescent chemosensor for Al(III) ions based on 2-hydroxy-1-naphthaldehyde derivative. In Canadian journal of chemistry. ISSN 0008-4042, 2019, vol. 97, no. 5, pp. 387-391.
LI, Yong-Peng - ZHU, Xiao-Han - LI, Shu-Ni - JIANG, Yu-Cheng - HU, Man-Cheng - ZHAI, Quan-Guo. Highly selective and sensitive turn-off-on fluorescent probes for sensing Al3+ ions designed by regulating the excited-state intramolecular proton transfer process in metal-organic frameworks. In ACS applied materials and interfaces. ISSN 1944-8244, 2019, vol. 11, no. 12, pp. 11338-11348.
SONG, Yuzhi - LIU, Shuang - YANG, Yunfan - WEI, Dongmei - PAN, Jie - LI, Yongqing. A detecting Al3+ ion luminophor 2-(Anthracen-1-yliminomethyl)-phenol : theoretical investigation on the fluorescence properties and ESIPT mechanism. In Spectrochimica acta. Part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2019, vol. 208, pp. 309-314.
YIN, Caixia - LI, Jiawei - HUO, Fangjun. Cu2+ Biological imaging probes based on different sensing mechanisms. In Current medicinal chemistry. ISSN 0929-8673, 2019, vol. 26, no. 21, pp. 3958-4002.
WANG, Man - CHENG, Caiqi - SONG, Jintong - WANG, Jun - ZHOU, Xiangge - XIANG, Haifeng - LIU, Jin. Multiple hydrogen bonds promoted ESIPT and AIE-active chiral salicylaldehyde hydrazide. In Chinese journal of chemistry. ISSN 1001-604X, 2018, vol. 36, no. 8, pp. 698-707.
WANG, Dejia - FAN, Xiaopeng - SUN, Shiguo - DU, Shaozhi - LI, Hongjuan - ZHU, Jinli - TANG, Yanfeng - CHANG, Mingxin - XU, Yongqian. Substituent effect : a new strategy to construct a ratiometric fluorescent probe for detection of Al3+ and imaging in vivo. In Sensors and actuators B : chemical. ISSN 0925-4005, 2018, vol. 264, pp. 304-311.
YANG, Yunfan - DING, Yong - ZHAO, Yu - MA, Fengcai - LI, Yongqing. Reaction mechanism of photodeamination induced by excited-state intramolecular proton transfer of the anthrol molecule. In Journal of physical chemistry A. ISSN 1089-5639, 2018, vol. 122, no. 24, pp. 5409-5417.
MAWAI, Kiran - NATHANI, Sandip - ROY, Partha - SINGH, U. P. - GHOSH, Kaushik. Combined experimental and theoretical studies on selective sensing of zinc and pyrophosphate ions by rational design of compartmental chemosensor probe : dual sensing behaviour via secondary recognition approach and cell imaging studies. In Dalton transactions. ISSN 1477-9226, 2018, vol. 47, no. 18, pp. 6421-6434.
SUN, Changyan - SUN, Jiayi - QIU, Fazheng - LI, Wenjun - CHANG, Zhidong - ZHANG, Lijun. The fluorescent property of 3-[(2-hydroxy-1-naphthyl) methylideneamino]benzoic acid and its application as fluorescent chemosensor for Hg2+ and Al3+ ions. In Spectrochimica acta. Part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2018, vol. 188, pp. 1-7.
LIANG, Chunshuang - JIANG, Shimei. Single sensor for multiple analytes in different optical channel : applying for multi-ion response modulation. In Spectrochimica acta. Part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2017, vol. 183, pp. 267-274.
LIAO, Zhuang - LIU, Yang - HAN, Su-Fang - WANG, Dan - ZHENG, Jian-Quan - ZHENG, Xiang-Jun - JIN, Lin-Pei. A novel acylhydrazone-based derivative as dualmode chemosensor for Al3+, Zn2+ and Fe3+ and its applications in cell imaging. In Sensors and actuators B : chemical. ISSN 0925-4005, 2017, vol. 244, pp. 914-921.
Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika 
nerozpoznaný
Názov First-principles simulations of one- and two-photon absorption band shapes of the bis(BF2) core complex Aut.údaje Robert Zaleśny ... [et al.] Autor Zaleśny Robert 1977- (40%) UMBFP08 - Katedra chémie
Spoluautori Murugan N. Arul (15%)
Tian Guangjun (15%)
Medveď Miroslav 1971- (15%) UMBFP08 - Katedra chémie
Ågren Hans (15%)
Zdroj.dok. The Journal of Physical Chemistry B. Vol. 120, no. 9 (2016), pp. 2323-2332. - Washington : The American Chemical Society, 2016 Kľúč.slová chémia - chemistry fotóny - photons Jazyk dok. angličtina Krajina Spojené štáty Systematika 54 Anotácia Motivated by the outstanding properties of bis(BF2) core complexes as fluorophore probes, we present a systematic computational study of their vibrationally resolved one- and two-photon absorption spectra in vacuum and in solution. Electronic and vibrational structure calculations were performed using the coupled cluster CC2 method and the Kohn-Sham formulation of density functional theory (DFT). A nonempirical estimation of the inhomogeneous broadening, accomplished using the polarizable embedding (PE) approaches combined with time-dependent DFT and CC2 methods, is used as a key ingredient of the computational protocol employed for simulations of the spectral features in solution. The inhomogeneous broadening is also determined based on the Marcus theory employing linear response and state-specific polarizable continuum model (PCM) methods. It is found that the polarizable embedding CC2 and the state-specific PCM are the most successful approaches for description of environmental broadening. For the 1(1)A(g)> 1(1)B(u) transition, the non-Condon effects can be safely neglected and a fair agreement between the simulated and experimental band shapes is found. In contrast, the shape of the vibrationally resolved band corresponding to the two-photon allowed 1(1)A(g)> 2(1)A(g) transition is largely dominated by non-Condon effects. A generalized few-level model was also employed to analyze the mechanism of the electronic two-photon 1(1)A(g)> 2(1)A(g) excitation. It was found that the most important optical channel involves the 1(1)B(u) excited state. Ramifications of the findings for general band shape modeling are briefly discussed. Kategória publikačnej činnosti ADC Číslo archívnej kópie 37436 Katal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Báza dát xpca - PUBLIKAČNÁ ČINNOSŤ Odkazy PERIODIKÁ-Súborný záznam periodika nerozpoznaný