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Bozkaya, Uğur
154
results:
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Online (154)
Mediatypes
Articles (Online) (67)
Bookchapter (Online) (2)
OpenAccess-fulltext (85)
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?
1
Reduction of 2-phenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3..:
Gündoğdu, Özlem
;
Atalay, Abdurrahman
;
Turhan, Pınar
...
Journal of Molecular Structure. 1319 (2025) - p. 139520 , 2025
Link:
https://doi.org/10.1016/..
?
2
Coupled-cluster theory and chemical reactivity:
, In:
Chemical Reactivity
,
Bozkaya, Uğur
- p. 65-81 , 2023
Link:
https://doi.org/10.1016/..
?
3
Contributors:
, In:
Chemical Reactivity
,
Akbarov, Khamdam
;
Astudillo-Sánchez, P.D.
;
Ayarde-Henríquez, Leandro
... - p. xv-xvii , 2023
Link:
https://doi.org/10.1016/..
?
4
Accurate property prediction by second order perturbation t..:
Behnle, Stefan
;
Richter, Robert
;
Völkl, Luca
...
The Journal of Chemical Physics. 157 (2022) 10 - p. , 2022
Link:
https://doi.org/10.1063/..
?
5
Efficient Implementation of Equation-of-Motion Coupled-Clus..:
Ünal, Aslı
;
Bozkaya, Uğur
Journal of Chemical Theory and Computation. 18 (2022) 3 - p. 1489-1500 , 2022
Link:
https://doi.org/10.1021/..
?
6
Linear-Scaling Systematic Molecular Fragmentation Approach ..:
Bozkaya, Uğur
;
Ermiş, Betül
Journal of Chemical Theory and Computation. 18 (2022) 9 - p. 5349-5359 , 2022
Link:
https://doi.org/10.1021/..
?
7
Regio- and stereo-chemical ring-opening reactions of the 2,..:
Gündoğdu, Özlem
;
Atalay, Abdurrahman
;
Çelebioğlu, Neslihan
...
Journal of Molecular Structure. 1264 (2022) - p. 133163 , 2022
Link:
https://doi.org/10.1016/..
?
8
Efficient and regioselective synthesis of dihydroxy-substit..:
Polat, İlknur
;
Eşsiz, Selçuk
;
Bozkaya, Uğur
.
Beilstein Journal of Organic Chemistry. 18 (2022) - p. 77-85 , 2022
Link:
https://doi.org/10.3762/..
?
9
MacroQC 1.0: An electronic structure theory software for la..:
Bozkaya, Uğur
;
Ermiş, Betül
;
Alagöz, Yavuz
..
The Journal of Chemical Physics. 156 (2022) 4 - p. , 2022
Link:
https://doi.org/10.1063/..
?
10
Efficient implementations of the symmetric and asymmetric t..:
Alagöz, Yavuz
;
Ünal, Aslı
;
Bozkaya, Uğur
The Journal of Chemical Physics. 155 (2021) 11 - p. , 2021
Link:
https://doi.org/10.1063/..
?
11
A computational study of the reaction mechanism of 2,2-azob..:
Eşsiz, Selçuk
;
Bozkaya, Uğur
Organic & Biomolecular Chemistry. 19 (2021) 43 - p. 9483-9490 , 2021
Link:
https://doi.org/10.1039/..
?
12
Molint 1.0: A framework for the computation of molecular in..:
Bozkaya, Uğur
International Journal of Quantum Chemistry. 121 (2021) 11 - p. , 2021
Link:
https://doi.org/10.1002/..
?
13
State-Of-The-Art Computations of Vertical Electron Affiniti..:
Ermiş, Betül
;
Ekinci, Emel
;
Bozkaya, Uğur
Journal of Chemical Theory and Computation. 17 (2021) 12 - p. 7648-7656 , 2021
Link:
https://doi.org/10.1021/..
?
14
PSI4 1.4: Open-source software for high-throughput quantum ..:
Smith, Daniel G. A.
;
Burns, Lori A.
;
Simmonett, Andrew C.
...
The Journal of Chemical Physics. 152 (2020) 18 - p. , 2020
Link:
https://doi.org/10.1063/..
?
15
Polarization‐Enhanced Hydrogen Bonding in 1,8‐Dihydroxynaph..:
Mammadova, Flora
;
Hamarat, Büşra
;
Ahmadli, Dilgam
...
ChemistrySelect. 5 (2020) 42 - p. 13387-13396 , 2020
Link:
https://doi.org/10.1002/..
1-15