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Cernušák, Ivan
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1

Theoretical insights into the HO●-induced oxidation of chlo..:

Truong, Dinh Hieu ; Nguyen, Thi Le Anh ; Alharzali, Nissrin...
Chemosphere.  350 (2024)  - p. 141085 , 2024
Link: https://doi.org/10.1016/..
 
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2

Hydroxyl radical-initiated decomposition of metazachlor her..:

Dao, Duy Quang ; Taamalli, Sonia ; Louis, Florent...
Chemosphere.  312 (2023)  - p. 137234 , 2023
Link: https://doi.org/10.1016/..
 
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3

Theoretical insights into the oxidation of quinmerac herbic..:

Ngo, Thi Chinh ; Taamalli, Sonia ; Srour, Zainab...
Journal of Environmental Chemical Engineering.  11 (2023)  3 - p. 109941 , 2023
Link: https://doi.org/10.1016/..
 
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4

New insight into environmental oxidation of phosmet insecti..:

K. Al Rawas, Hisham ; Al Mawla, Reem ; Pham, Thi Yen Nhi...
Environmental Science: Processes & Impacts.  25 (2023)  12 - p. 2042-2056 , 2023
Link: https://doi.org/10.1039/..
 
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5

Cyclo[n]carbons and catenanes from different perspectives: ..:

Kozáková, Silvia ; Alharzali, Nissrin ; Černušák, Ivan
Physical Chemistry Chemical Physics.  25 (2023)  43 - p. 29386-29403 , 2023
Link: https://doi.org/10.1039/..
 
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6

Together, Not Separately, OH and O3 Oxidize Hg(0) to Hg(II)..:

Castro, Pedro J. ; Kellö, Vladimir ; Cernušák, Ivan.
The Journal of Physical Chemistry A.  126 (2022)  44 - p. 8266-8279 , 2022
Link: https://doi.org/10.1021/..
 
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7

Improved Mechanistic Model of the Atmospheric Redox Chemist..:

Shah, Viral ; Jacob, Daniel J. ; Thackray, Colin P....
Environmental Science & Technology.  55 (2021)  21 - p. 14445-14456 , 2021
Link: https://doi.org/10.1021/..
 
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8

Thermochemical and kinetic studies of hydrogen abstraction ..:

Khiri, Dorra ; Taamalli, Sonia ; Dao, Duy Quang...
Computational and Theoretical Chemistry.  1201 (2021)  - p. 113257 , 2021
Link: https://doi.org/10.1016/..
 
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9

Ab initio molecular dynamics investigation of Cs adsorption..:

Said, Halima ; Novotný, Michal ; Černušák, Ivan.
Applied Surface Science.  559 (2021)  - p. 149822 , 2021
Link: https://doi.org/10.1016/..
 
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10

Theoretical Study of the Monohydration of Mercury Compounds..:

Taamalli, Sonia ; Pitoňák, Michal ; Dibble, Theodore S...
The Journal of Physical Chemistry A.  125 (2021)  26 - p. 5819-5828 , 2021
Link: https://doi.org/10.1021/..
 
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11

Spectroscopic properties of diatomic molecules CdI and CsCd..:

Kozáková, Silvia ; Černušák, Ivan
Theoretical Chemistry Accounts.  139 (2020)  8 - p. , 2020
Link: https://doi.org/10.1007/..
 
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12

Atomic and ionic polarizabilities of B, C, N, O, and F:

Éhn, Ladislav ; Černušák, Ivan
International Journal of Quantum Chemistry.  121 (2020)  4 - p. , 2020
Link: https://doi.org/10.1002/..
 
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13

AuSi molecule revisited: IOTC/CASSCF/CASPT2 calculations:

Barysz, Maria ; Černušák, Ivan ; Kellö, Vladimir.
International Journal of Quantum Chemistry.  121 (2020)  5 - p. , 2020
Link: https://doi.org/10.1002/..
 
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14

On the applicability of the MP2.5 approximation for open-sh..:

Suliman, Siba ; Pitoňák, Michal ; Cernusak, Ivan.
Computational and Theoretical Chemistry.  1186 (2020)  - p. 112901 , 2020
Link: https://doi.org/10.1016/..
 
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15

BrHgO• + CO: Analogue of OH + CO and Reduction Path for Hg(..:

Khiri, Dorra ; Louis, Florent ; Černušák, Ivan.
ACS Earth and Space Chemistry.  4 (2020)  10 - p. 1777-1784 , 2020
Link: https://doi.org/10.1021/..
 
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