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Jiří Brabec
231  results:
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1

On‐Surface Synthesis and Determination of the Open‐Shell Si..:

Zuzak, Rafal ; Kumar, Manish ; Stoica, Otilia...
Angewandte Chemie International Edition.  63 (2024)  9 - p. , 2024
Link: https://doi.org/10.1002/..
 
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2

On‐Surface Synthesis and Determination of the Open‐Shell Si..:

Zuzak, Rafal ; Kumar, Manish ; Stoica, Otilia...
Angewandte Chemie.  136 (2024)  9 - p. , 2024
Link: https://doi.org/10.1002/..
 
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3

Highly entangled polyradical nanographene with coexisting s..:

Song, Shaotang ; Pinar Solé, Andrés ; Matěj, Adam...
Nature Chemistry.  16 (2024)  6 - p. 938-944 , 2024
Link: https://doi.org/10.1038/..
 
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4

TAMM: Tensor algebra for many-body methods:

Mutlu, Erdal ; Panyala, Ajay ; Gawande, Nitin...
The Journal of Chemical Physics.  159 (2023)  2 - p. , 2023
Link: https://doi.org/10.1063/..
 
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5

Hilbert space multireference coupled cluster tailored by ma..:

Demel, Ondřej ; Brandejs, Jan ; Lang, Jakub...
The Journal of Chemical Physics.  159 (2023)  22 - p. , 2023
Link: https://doi.org/10.1063/..
 
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6

Role of Spin Polarization and Dynamic Correlation in Single..:

Drwal, Daria ; Matousek, Mikulas ; Golub, Pavlo...
Journal of Chemical Theory and Computation.  19 (2023)  21 - p. 7606-7616 , 2023
Link: https://doi.org/10.1021/..
 
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7

Mutual information prediction for strongly correlated syste..:

Golub, Pavlo ; Antalik, Andrej ; Beran, Pavel.
Chemical Physics Letters.  813 (2023)  - p. 140297 , 2023
Link: https://doi.org/10.1016/..
 
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8

The Effect of Geometry, Spin, and Orbital Optimization in A..:

Mejuto-Zaera, Carlos ; Tzeli, Demeter ; Williams-Young, David...
Journal of Chemical Theory and Computation.  18 (2022)  2 - p. 687-702 , 2022
Link: https://doi.org/10.1021/..
 
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9

Interplay between π-Conjugation and Exchange Magnetism in O..:

Biswas, Kalyan ; Urbani, Maxence ; Sánchez-Grande, Ana...
Journal of the American Chemical Society.  144 (2022)  28 - p. 12725-12731 , 2022
Link: https://doi.org/10.1021/..
 
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10

On-Surface Strain-Driven Synthesis of Nonalternant Non-Benz..:

Mallada, Benjamin ; de la Torre, Bruno ; Mendieta-Moreno, Jesús I....
Journal of the American Chemical Society.  143 (2021)  36 - p. 14694-14702 , 2021
Link: https://doi.org/10.1021/..
 
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11

Machine Learning-Assisted Selection of Active Spaces for St..:

Golub, Pavlo ; Antalik, Andrej ; Veis, Libor.
Journal of Chemical Theory and Computation.  17 (2021)  10 - p. 6053-6072 , 2021
Link: https://doi.org/10.1021/..
 
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12

Propeller Selection by Means of Pareto-Optimal Sets Applied..:

Slavik, Svatomir ; Klesa, Jan ; Brabec, Jiri
Aerospace.  7 (2020)  3 - p. 21 , 2020
Link: https://doi.org/10.3390/..
 
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13

Massively parallel quantum chemical density matrix renormal..:

Brabec, Jiri ; Brandejs, Jan ; Kowalski, Karol...
Journal of Computational Chemistry.  42 (2020)  8 - p. 534-544 , 2020
Link: https://doi.org/10.1002/..
 
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14

Near-Linear Scaling in DMRG-Based Tailored Coupled Clusters..:

Lang, Jakub ; Antalík, Andrej ; Veis, Libor...
Journal of Chemical Theory and Computation.  16 (2020)  5 - p. 3028-3040 , 2020
Link: https://doi.org/10.1021/..
 
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15

Solving Coupled Cluster Equations by the Newton Krylov Meth..:

Yang, Chao ; Brabec, Jiri ; Veis, Libor..
Frontiers in Chemistry.  8 (2020)  - p. , 2020
Link: https://doi.org/10.3389/..
 
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