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do Casal, Mariana T.
75  Ergebnisse:
Personensuche X
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1

Classification of doubly excited molecular electronic state:

do Casal, Mariana T. ; Toldo, Josene M. ; Barbatti, Mario.
Chemical Science.  14 (2023)  15 - p. 4012-4026 , 2023
Link: https://doi.org/10.1039/..
 
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2

First-Principles Calculations of Excited-State Decay Rate C..:

do Casal, Mariana T. ; Veys, Koen ; Bousquet, Manon H. E...
The Journal of Physical Chemistry A.  127 (2023)  48 - p. 10033-10053 , 2023
Link: https://doi.org/10.1021/..
 
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3

Surface hopping modeling of charge and energy transfer in a..:

Toldo, Josene M. ; do Casal, Mariana T. ; Ventura, Elizete..
Physical Chemistry Chemical Physics.  25 (2023)  12 - p. 8293-8316 , 2023
Link: https://doi.org/10.1039/..
 
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4

Probing the electronic structure and photophysics of thioph..:

Polak, Daniel W. ; do Casal, Mariana T. ; Toldo, Josene M....
Physical Chemistry Chemical Physics.  24 (2022)  34 - p. 20138-20151 , 2022
Link: https://doi.org/10.1039/..
 
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5

Correction: Modeling the heating and cooling of a chromopho..:

Ventura, Elizete ; do Monte, Silmar Andrade ; do Casal, Mariana T....
Physical Chemistry Chemical Physics.  24 (2022)  25 - p. 15604-15604 , 2022
Link: https://doi.org/10.1039/..
 
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6

Direct structural observation of ultrafast photoisomerizati..:

Abiola, Temitope T. ; Toldo, Josene M. ; do Casal, Mariana T....
Communications Chemistry.  5 (2022)  1 - p. , 2022
Link: https://doi.org/10.1038/..
 
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7

Using diketopyrrolopyrroles to stabilize double excitation ..:

do Casal, Mariana T. ; Toldo, Josene M. ; Plasser, Felix.
Physical Chemistry Chemical Physics.  24 (2022)  38 - p. 23279-23288 , 2022
Link: https://doi.org/10.1039/..
 
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8

Mechanistic Aspects of the Photophysics of UVA Filters Base..:

Toldo, Josene M. ; do Casal, Mariana T. ; Barbatti, Mario
The Journal of Physical Chemistry A.  125 (2021)  25 - p. 5499-5508 , 2021
Link: https://doi.org/10.1021/..
 
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9

Excitonic and charge transfer interactions in tetracene sta..:

C. A. Valente, Daniel ; do Casal, Mariana T. ; Barbatti, Mario...
The Journal of Chemical Physics.  154 (2021)  4 - p. , 2021
Link: https://doi.org/10.1063/..
 
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10

Impact of low-cost methods in the description of excimer an..:

do Casal, Mariana T. ; Cardozo, Thiago M.
Theoretical Chemistry Accounts.  139 (2020)  8 - p. , 2020
Link: https://doi.org/10.1007/..
 
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11

New Generation UV-A Filters: Understanding Their Photodynam..:

Abiola, Temitope T. ; Rodrigues, Natércia d. N. ; Ho, Casey...
The Journal of Physical Chemistry Letters.  12 (2020)  1 - p. 337-344 , 2020
Link: https://doi.org/10.1021/..
 
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12

Design and Synthesis of Asymmetric Au(III) Complexes Exhibi..:

Kuo, Hsin‐Hung ; Kumar, Sudhir ; Omongos, Rashen Lou...
Advanced Optical Materials.  11 (2023)  12 - p. , 2023
Link: https://doi.org/10.1002/..
 
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13

Fewest switches surface hopping with Baeck-An couplings:

T. do Casal, Mariana ; Toldo, Josene M. ; Pinheiro Jr, Max.
Open Research Europe.  1 (2022)  - p. 49 , 2022
Link: https://doi.org/10.12688..
 
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14

Modeling the heating and cooling of a chromophore after pho..:

Ventura, Elizete ; Andrade do Monte, Silmar ; T. do Casal, Mariana...
Physical Chemistry Chemical Physics.  24 (2022)  16 - p. 9403-9410 , 2022
Link: https://doi.org/10.1039/..
 
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15

Fewest switches surface hopping with Baeck-An couplings:

T. do Casal, Mariana ; Toldo, Josene M. ; Pinheiro Jr, Max.
Open Research Europe.  1 (2021)  - p. 49 , 2021
Link: https://doi.org/10.12688..
 
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