Year |
Citation |
Score |
2024 |
Prakash O, Lindh L, Gupta AK, Hoang Hai YT, Kaul N, Chábera P, Lindgren F, Ericsson T, Häggström L, Strand D, Yartsev A, Lomoth R, Persson P, Wärnmark K. Correction to "Tailoring the Photophysical Properties of a Homoleptic Iron(II) Tetra -Heterocyclic Carbene Complex by Attaching an Imidazolium Group to the (CNC) Pincer Ligand─A Comparative Study". Inorganic Chemistry. PMID 38564587 DOI: 10.1021/acs.inorgchem.4c01017 |
0.581 |
|
2024 |
Prakash O, Chábera P, Kaul N, Hlynsson VF, Rosemann NW, Losada IB, Hoang Hai YT, Huang P, Bendix J, Ericsson T, Häggström L, Gupta AK, Strand D, Yartsev A, Lomoth R, ... Persson P, et al. How Rigidity and Conjugation of Bidentate Ligands Affect the Geometry and Photophysics of Iron -Heterocyclic Complexes: A Comparative Study. Inorganic Chemistry. PMID 38421802 DOI: 10.1021/acs.inorgchem.3c03972 |
0.572 |
|
2024 |
Prakash O, Lindh L, Gupta AK, Hoang Hai YT, Kaul N, Chábera P, Lindgren F, Ericsson T, Häggström L, Strand D, Yartsev A, Lomoth R, Persson P, Wärnmark K. Tailoring the Photophysical Properties of a Homoleptic Iron(II) Tetra -Heterocyclic Carbene Complex by Attaching an Imidazolium Group to the (CNC) Pincer Ligand─A Comparative Study. Inorganic Chemistry. PMID 38301278 DOI: 10.1021/acs.inorgchem.3c02890 |
0.664 |
|
2023 |
Losada IB, Persson P. Ligand-centered to metal-centered activation of a Rh(iii) photosensitizer revealed by molecular dynamics simulations. Chemical Science. 14: 13713-13721. PMID 38075662 DOI: 10.1039/d3sc04381a |
0.399 |
|
2023 |
Lindh L, Pascher T, Persson S, Goriya Y, Wärnmark K, Uhlig J, Chábera P, Persson P, Yartsev A. Multifaceted Deactivation Dynamics of Fe(II) -Heterocyclic Carbene Photosensitizers. The Journal of Physical Chemistry. A. PMID 38000043 DOI: 10.1021/acs.jpca.3c06983 |
0.669 |
|
2023 |
Jones RW, Auty AJ, Wu G, Persson P, Appleby MV, Chekulaev D, Rice CR, Weinstein JA, Elliott PIP, Scattergood PA. Direct Determination of the Rate of Intersystem Crossing in a Near-IR Luminescent Cr(III) Triazolyl Complex. Journal of the American Chemical Society. PMID 37224437 DOI: 10.1021/jacs.3c01543 |
0.381 |
|
2023 |
Rosemann NW, Lindh L, Bolaño Losada I, Kaufhold S, Prakash O, Ilic A, Schwarz J, Wärnmark K, Chábera P, Yartsev A, Persson P. Competing dynamics of intramolecular deactivation and bimolecular charge transfer processes in luminescent Fe(iii) N-heterocyclic carbene complexes. Chemical Science. 14: 3569-3579. PMID 37006696 DOI: 10.1039/d2sc05357h |
0.644 |
|
2022 |
Prakash O, Lindh L, Kaul N, Rosemann NW, Losada IB, Johnson C, Chábera P, Ilic A, Schwarz J, Gupta AK, Uhlig J, Ericsson T, Häggström L, Huang P, Bendix J, ... ... Persson P, et al. Photophysical Integrity of the Iron(III) Scorpionate Framework in Iron(III)-NHC Complexes with Long-Lived LMCT Excited States. Inorganic Chemistry. PMID 36279568 DOI: 10.1021/acs.inorgchem.2c02410 |
0.683 |
|
2022 |
Schmid L, Chábera P, Rüter I, Prescimone A, Meyer F, Yartsev A, Persson P, Wenger OS. Borylation in the Second Coordination Sphere of Fe Cyanido Complexes and Its Impact on Their Electronic Structures and Excited-State Dynamics. Inorganic Chemistry. PMID 36167335 DOI: 10.1021/acs.inorgchem.2c01667 |
0.703 |
|
2021 |
Lindh L, Gordivska O, Persson S, Michaels H, Fan H, Chábera P, Rosemann NW, Gupta AK, Benesperi I, Uhlig J, Prakash O, Sheibani E, Kjaer KS, Boschloo G, Yartsev A, ... ... Persson P, et al. Dye-sensitized solar cells based on Fe N-heterocyclic carbene photosensitizers with improved rod-like push-pull functionality. Chemical Science. 12: 16035-16053. PMID 35024126 DOI: 10.1039/d1sc02963k |
0.678 |
|
2021 |
Temperton RH, Guo M, D'Acunto G, Johansson N, Rosemann NW, Prakash O, Wärnmark K, Schnadt J, Uhlig J, Persson P. Resonant X-ray photo-oxidation of light-harvesting iron (II/III) N-heterocyclic carbene complexes. Scientific Reports. 11: 22144. PMID 34772983 DOI: 10.1038/s41598-021-01509-7 |
0.404 |
|
2021 |
Kaufhold S, Rosemann NW, Chábera P, Lindh L, Bolaño Losada I, Uhlig J, Pascher T, Strand D, Wärnmark K, Yartsev A, Persson P. Microsecond Photoluminescence and Photoreactivity of a Metal-Centered Excited State in a Hexacarbene-Co(III) Complex. Journal of the American Chemical Society. PMID 33449685 DOI: 10.1021/jacs.0c12151 |
0.677 |
|
2021 |
Chábera P, Lindh L, Rosemann NW, Prakash O, Uhlig J, Yartsev A, Wärnmark K, Sundström V, Persson P. Photofunctionality of iron(III) N-heterocyclic carbenes and related d transition metal complexes Coordination Chemistry Reviews. 426: 213517. DOI: 10.1016/J.Ccr.2020.213517 |
0.757 |
|
2020 |
Wärnmark K, Prakash O, Chábera P, Rosemann NW, Huang P, Häggström L, Ericsson T, Strand D, Persson P, Bendix J, Lomoth R. A Stable Homoleptic Organometallic Iron(IV) Complex. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 32369645 DOI: 10.1002/Chem.202002158 |
0.485 |
|
2020 |
Rosemann NW, Chábera P, Prakash O, Kaufhold S, Wärnmark K, Yartsev A, Persson P. Tracing the Full Bimolecular Photocycle of Iron(III)-Carbene Light Harvesters in Electron-Donating Solvents. Journal of the American Chemical Society. PMID 32307993 DOI: 10.1021/Jacs.0C00755 |
0.671 |
|
2020 |
Guo M, Prakash O, Fan H, de Groot LHM, Hlynsson VF, Kaufhold S, Gordivska O, Velásquez N, Chabera P, Glatzel P, Wärnmark K, Persson P, Uhlig J. HERFD-XANES probes of electronic structures of iron carbene complexes. Physical Chemistry Chemical Physics : Pccp. PMID 32297625 DOI: 10.1039/C9Cp06309A |
0.491 |
|
2020 |
Temperton RH, Rosemann NW, Guo M, Johansson N, Fredin LA, Prakash O, Wärnmark K, Handrup K, Uhlig J, Schnadt J, Persson P. Site-Selective Orbital Interactions in an Ultrathin Iron-Carbene Photosensitizer Film. The Journal of Physical Chemistry. A. PMID 32011141 DOI: 10.1021/Acs.Jpca.0C00803 |
0.435 |
|
2020 |
Kunnus K, Vacher M, Harlang TCB, Kjær KS, Haldrup K, Biasin E, van Driel TB, Pápai M, Chabera P, Liu Y, Tatsuno H, Timm C, Källman E, Delcey M, Hartsock RW, ... ... Persson P, et al. Vibrational wavepacket dynamics in Fe carbene photosensitizer determined with femtosecond X-ray emission and scattering. Nature Communications. 11: 634. PMID 32005815 DOI: 10.1038/S41467-020-14468-W |
0.609 |
|
2020 |
Lindh L, Chábera P, Rosemann NW, Uhlig J, Wärnmark K, Yartsev A, Sundström V, Persson P. Photophysics and Photochemistry of Iron Carbene Complexes for Solar Energy Conversion and Photocatalysis Catalysts. 10: 315. DOI: 10.3390/Catal10030315 |
0.755 |
|
2019 |
Fredin LA, Wallenstein J, Sundin E, Jarenmark M, Barbosa de Mattos DF, Persson P, Abrahamsson M. Excited State Dynamics of Bistridentate and Trisbidentate Ru Complexes of Quinoline-Pyrazole Ligands. Inorganic Chemistry. PMID 31800221 DOI: 10.1021/Acs.Inorgchem.9B01543 |
0.531 |
|
2019 |
Tatsuno H, Kjaer KS, Kunnus K, Harlang T, Timm C, Guo M, Chabera P, Fredin L, Hartsock R, Reinhard M, Koroidov S, Li L, Cordones A, Gordivska O, Prakash O, ... ... Persson P, et al. Hot branching dynamics in a light-harvesting iron carbene complex revealed by ultrafast x-ray emission spectroscopy. Angewandte Chemie (International Ed. in English). PMID 31602726 DOI: 10.1002/Anie.201908065 |
0.639 |
|
2019 |
Kjær KS, Van Driel TB, Harlang TCB, Kunnus K, Biasin E, Ledbetter K, Hartsock RW, Reinhard ME, Koroidov S, Li L, Laursen MG, Hansen FB, Vester P, Christensen M, Haldrup K, ... ... Persson P, et al. Finding intersections between electronic excited state potential energy surfaces with simultaneous ultrafast X-ray scattering and spectroscopy. Chemical Science. 10: 5749-5760. PMID 31293761 DOI: 10.1039/C8Sc04023K |
0.461 |
|
2019 |
Ashfold M, Bender J, Beratan DN, Bradforth S, Cina J, Datta A, Dawlaty J, Dill R, Dodin A, Duchi M, Estergreen L, Fleming G, Frankcombe T, Gate G, Gessner O, ... ... Persson P, et al. Photo-induced electron transfer: general discussion. Faraday Discussions. PMID 31259976 DOI: 10.1039/C9Fd90029B |
0.333 |
|
2019 |
Fredin LA, Persson P. Influence of Triplet Surface Properties on Excited-State Deactivation of Expanded Cage Bis(tridentate)Ruthenium(II) Complexes. The Journal of Physical Chemistry. A. PMID 31199149 DOI: 10.1021/Acs.Jpca.9B02927 |
0.545 |
|
2019 |
Chábera P, Fredin LA, Kjær KS, Rosemann NW, Lindh L, Prakash O, Liu Y, Wärnmark K, Uhlig J, Sundström V, Yartsev A, Persson P. Band-selective dynamics in charge-transfer excited iron carbene complexes. Faraday Discussions. PMID 31016293 DOI: 10.1039/C8Fd00232K |
0.769 |
|
2018 |
Kjær KS, Kaul N, Prakash O, Chábera P, Rosemann NW, Honarfar A, Gordivska O, Fredin LA, Bergquist KE, Häggström L, Ericsson T, Lindh L, Yartsev A, Styring S, Huang P, ... ... Persson P, et al. Luminescence and reactivity of a charge-transfer excited iron complex with nanosecond lifetime. Science (New York, N.Y.). PMID 30498167 DOI: 10.1126/Science.Aau7160 |
0.759 |
|
2018 |
Leshchev D, Harlang TCB, Fredin LA, Khakhulin D, Liu Y, Biasin E, Laursen MG, Newby GE, Haldrup K, Nielsen MM, Wärnmark K, Sundström V, Persson P, Kjær KS, Wulff M. Tracking the picosecond deactivation dynamics of a photoexcited iron carbene complex by time-resolved X-ray scattering. Chemical Science. 9: 405-414. PMID 29629111 DOI: 10.1039/C7Sc02815F |
0.675 |
|
2018 |
Kjær KS, Kunnus K, Harlang TCB, Van Driel TB, Ledbetter K, Hartsock RW, Reinhard ME, Koroidov S, Li L, Laursen MG, Biasin E, Hansen FB, Vester P, Christensen M, Haldrup K, ... ... Persson P, et al. Solvent control of charge transfer excited state relaxation pathways in [Fe(2,2'-bipyridine)(CN)4]2. Physical Chemistry Chemical Physics : Pccp. PMID 29364300 DOI: 10.1039/C7Cp07838B |
0.526 |
|
2018 |
Chabera P, Kjær KS, Prakash O, Honarfar A, Liu Y, Fredin LA, Harlang TB, Lidin S, Uhlig J, Sundstrom V, Lomoth R, Persson P, Wärnmark K. A FeII Hexa N-Heterocyclic Carbene Complex with a 528 ps Metal-to-Ligand Charge-Transfer Excited-State Lifetime. The Journal of Physical Chemistry Letters. PMID 29298063 DOI: 10.1021/Acs.Jpclett.7B02962 |
0.676 |
|
2017 |
Ponseca CS, Chábera P, Uhlig J, Persson P, Sundström V. Ultrafast Electron Dynamics in Solar Energy Conversion. Chemical Reviews. PMID 28805062 DOI: 10.1021/Acs.Chemrev.6B00807 |
0.559 |
|
2017 |
Kjær KS, Zhang W, Alonso-Mori R, Bergmann U, Chollet M, Hadt RG, Hartsock RW, Harlang T, Kroll T, Kubiček K, Lemke HT, Liang HW, Liu Y, Nielsen MM, Robinson JS, ... ... Persson P, et al. Ligand manipulation of charge transfer excited state relaxation and spin crossover in [Fe(2,2'-bipyridine)2(CN)2]. Structural Dynamics (Melville, N.Y.). 4: 044030. PMID 28653021 DOI: 10.1063/1.4985017 |
0.647 |
|
2017 |
Zhang W, Kjær KS, Alonso-Mori R, Bergmann U, Chollet M, Fredin LA, Hadt RG, Hartsock RW, Harlang T, Kroll T, Kubiček K, Lemke HT, Liang HW, Liu Y, Nielsen MM, ... Persson P, et al. Manipulating charge transfer excited state relaxation and spin crossover in iron coordination complexes with ligand substitution. Chemical Science. 8: 515-523. PMID 28451198 DOI: 10.1039/C6Sc03070J |
0.673 |
|
2017 |
Chábera P, Liu Y, Prakash O, Thyrhaug E, Nahhas AE, Honarfar A, Essén S, Fredin LA, Harlang TC, Kjær KS, Handrup K, Ericson F, Tatsuno H, Morgan K, Schnadt J, ... ... Persson P, et al. A low-spin Fe(iii) complex with 100-ps ligand-to-metal charge transfer photoluminescence. Nature. 543: 695-699. PMID 28358064 DOI: 10.1038/Nature21430 |
0.671 |
|
2017 |
Gałyńska M, Persson P. Quantum chemical calculations of the structural influence on electronic properties in TiO2 nanocrystals Molecular Physics. 115: 2209-2217. DOI: 10.1080/00268976.2017.1281456 |
0.37 |
|
2017 |
Ericson F, Honarfar A, Prakash O, Tatsuno H, Fredin LA, Handrup K, Chabera P, Gordivska O, Kjær KS, Liu Y, Schnadt J, Wärnmark K, Sundström V, Persson P, Uhlig J. Electronic structure and excited state properties of iron carbene photosensitizers – A combined X-ray absorption and quantum chemical investigation Chemical Physics Letters. 683: 559-566. DOI: 10.1016/J.Cplett.2017.03.085 |
0.654 |
|
2016 |
Fredin LA, Persson P. Computational characterization of competing energy and electron transfer states in bimetallic donor-acceptor systems for photocatalytic conversion. The Journal of Chemical Physics. 145: 104310. PMID 27634263 DOI: 10.1063/1.4962254 |
0.512 |
|
2016 |
Liu Y, Persson P, Sundström V, Wärnmark K. Fe N-Heterocyclic Carbene Complexes as Promising Photosensitizers. Accounts of Chemical Research. PMID 27455191 DOI: 10.1021/Acs.Accounts.6B00186 |
0.668 |
|
2016 |
Hedberg Wallenstein J, Fredin LA, Jarenmark M, Abrahamsson M, Persson P. Chemical consequences of pyrazole orientation in Ru(II) complexes of unsymmetric quinoline-pyrazole ligands. Dalton Transactions (Cambridge, England : 2003). PMID 27240703 DOI: 10.1039/C6Dt01070A |
0.431 |
|
2016 |
Fredin LA, Wärnmark K, Sundström V, Persson P. Molecular and Interfacial Calculations of Iron(II) Light Harvesters. Chemsuschem. PMID 27010851 DOI: 10.1002/Cssc.201600062 |
0.651 |
|
2016 |
Jarenmark M, Carlström G, Fredin LA, Hedberg Wallenstein J, Doverbratt I, Abrahamsson M, Persson P. Diastereomerization Dynamics of a Bistridentate Ru(II) Complex. Inorganic Chemistry. PMID 26962970 DOI: 10.1021/Acs.Inorgchem.5B02893 |
0.434 |
|
2016 |
Hedström S, Wang E, Persson P. Defining donor and acceptor strength in conjugated copolymers Molecular Physics. 1-12. DOI: 10.1080/00268976.2016.1181804 |
0.374 |
|
2016 |
Ma F, Jarenmark M, Hedström S, Persson P, Nordlander E, Yartsev A. Ultrafast excited state dynamics of [Cr(CO)4(bpy)]: Revealing the relaxation between triplet charge-transfer states Rsc Advances. 6: 20507-20515. DOI: 10.1039/C5Ra25670D |
0.681 |
|
2016 |
Fredin LA, Wärnmark K, Sundström V, Persson P. Cover Picture: Molecular and Interfacial Calculations of Iron(II) Light Harvesters (ChemSusChem 7/2016) Chemsuschem. 9: 651-651. DOI: 10.1002/Cssc.201600689 |
0.529 |
|
2016 |
James DI, Wang S, Ma W, Hedström S, Meng X, Persson P, Fabiano S, Crispin X, Andersson MR, Berggren M, Wang E. High-Performance Hole Transport and Quasi-Balanced Ambipolar OFETs Based on D-A-A Thieno-benzo-isoindigo Polymers Advanced Electronic Materials. 2: 1500313. DOI: 10.1002/Aelm.201500313 |
0.304 |
|
2015 |
Harlang TC, Liu Y, Gordivska O, Fredin LA, Ponseca CS, Huang P, Chábera P, Kjaer KS, Mateos H, Uhlig J, Lomoth R, Wallenberg R, Styring S, Persson P, Sundström V, et al. Iron sensitizer converts light to electrons with 92% yield. Nature Chemistry. 7: 883-9. PMID 26492008 DOI: 10.1038/Nchem.2365 |
0.631 |
|
2015 |
Kuhar K, Fredin LA, Persson P. Exploring Photoinduced Excited State Evolution in Heterobimetallic Ru(II)-Co(III) Complexes. The Journal of Physical Chemistry. B. 119: 7378-92. PMID 25719556 DOI: 10.1021/Jp510950U |
0.544 |
|
2015 |
Liu Y, Kjaer KS, Fredin LA, Chábera P, Harlang T, Canton SE, Lidin S, Zhang J, Lomoth R, Bergquist KE, Persson P, Wärnmark K, Sundström V. A heteroleptic ferrous complex with mesoionic bis(1,2,3-triazol-5-ylidene) ligands: taming the MLCT excited state of iron(II). Chemistry (Weinheim An Der Bergstrasse, Germany). 21: 3628-39. PMID 25504660 DOI: 10.1002/Chem.201405184 |
0.656 |
|
2015 |
Liu Y, Kjær KS, Fredin LA, Chábera P, Harlang T, Canton SE, Lidin S, Zhang J, Lomoth R, Bergquist KE, Persson P, Wärnmark K, Sundström V. A heteroleptic ferrous complex with mesoionic bis(1,2,3-triazol-5-ylidene) ligands: Taming the MLCT excited state of iron(II) Chemistry - a European Journal. 21: 3628-3639. DOI: 10.1002/chem.201405184 |
0.583 |
|
2014 |
Hansen T, Žídek K, Zheng K, Abdellah M, Chábera P, Persson P, Pullerits T. Orbital Topology Controlling Charge Injection in Quantum-Dot-Sensitized Solar Cells. The Journal of Physical Chemistry Letters. 5: 1157-62. PMID 26274464 DOI: 10.1021/Jz5001193 |
0.387 |
|
2014 |
Fredin LA, Pápai M, Rozsályi E, Vankó G, Wärnmark K, Sundström V, Persson P. Exceptional Excited-State Lifetime of an Iron(II)-N-Heterocyclic Carbene Complex Explained. The Journal of Physical Chemistry Letters. 5: 2066-71. PMID 26270494 DOI: 10.1021/Jz500829W |
0.679 |
|
2014 |
Jarenmark M, Fredin LA, Hedberg JH, Doverbratt I, Persson P, Abrahamsson M. A homoleptic trisbidentate Ru(II) complex of a novel bidentate biheteroaromatic ligand based on quinoline and pyrazole groups: structural, electrochemical, photophysical, and computational characterization. Inorganic Chemistry. 53: 12778-90. PMID 25420224 DOI: 10.1021/Ic502432C |
0.467 |
|
2014 |
Hedström S, Henriksson P, Wang E, Andersson MR, Persson P. Light-harvesting capabilities of low band gap donor-acceptor polymers. Physical Chemistry Chemical Physics : Pccp. 16: 24853-65. PMID 25318819 DOI: 10.1039/C4Cp03191A |
0.32 |
|
2014 |
Fredin LA, Pápai M, Rozsályi E, Vankó G, Wärnmark K, Sundström V, Persson P. Exceptional excited-state lifetime of an iron(II)- N -heterocyclic carbene complex explained Journal of Physical Chemistry Letters. 5: 2066-2071. DOI: 10.1021/jz500829w |
0.572 |
|
2014 |
Gałyńska M, Persson P. Material dependence of water interactions with metal oxide nanoparticles: TiO2, SiO2, GeO2, and SnO2 Advances in Quantum Chemistry. 69: 303-332. DOI: 10.1016/B978-0-12-800345-9.00008-8 |
0.374 |
|
2013 |
Kim SY, Kumar N, Persson P, Sofo J, van Duin AC, Kubicki JD. Development of a ReaxFF reactive force field for titanium dioxide/water systems. Langmuir : the Acs Journal of Surfaces and Colloids. 29: 7838-46. PMID 23687907 DOI: 10.1021/La4006983 |
0.307 |
|
2013 |
Parada GA, Fredin LA, Santoni MP, Jäger M, Lomoth R, Hammarström L, Johansson O, Persson P, Ott S. Tuning the electronics of bis(tridentate)ruthenium(II) complexes with long-lived excited states: modifications to the ligand skeleton beyond classical electron donor or electron withdrawing group decorations. Inorganic Chemistry. 52: 5128-37. PMID 23597274 DOI: 10.1021/Ic400009M |
0.559 |
|
2013 |
Mattias Andersson L, Hedström S, Persson P. Conformation sensitive charge transport in conjugated polymers Applied Physics Letters. 103. DOI: 10.1063/1.4832075 |
0.35 |
|
2013 |
Gałyńska M, Persson P. Emerging polymorphism in nanostructured TiO2: Quantum chemical comparison of anatase, rutile, and brookite clusters International Journal of Quantum Chemistry. 113: 2611-2620. DOI: 10.1002/Qua.24522 |
0.335 |
|
2012 |
Li J, Wang H, Persson P, Thoss M. Photoinduced electron transfer processes in dye-semiconductor systems with different spacer groups. The Journal of Chemical Physics. 137: 22A529. PMID 23249066 DOI: 10.1063/1.4746768 |
0.406 |
|
2012 |
Osterman T, Abrahamsson M, Becker HC, Hammarström L, Persson P. Influence of triplet state multidimensionality on excited state lifetimes of bis-tridentate RuII complexes: a computational study. The Journal of Physical Chemistry. A. 116: 1041-50. PMID 22148266 DOI: 10.1021/Jp207044A |
0.811 |
|
2012 |
Persson P, Knitter M, Galoppini E. Light-harvesting and electronic contacting capabilities of Ru(ii) Ipa rod and star complexes-first principles predictions Rsc Advances. 2: 7868-7874. DOI: 10.1039/C2Ra21240D |
0.434 |
|
2012 |
Hedström S, Persson P. Quantum Chemical Calculations of Side-Group Stacking and Electronic Properties in Thiophene–Quinoxaline Polymers The Journal of Physical Chemistry C. 116: 26700-26706. DOI: 10.1021/Jp308063U |
0.342 |
|
2012 |
Österman T, Persson P. Excited state potential energy surfaces of bistridentate RuII complexes – A TD-DFT study Chemical Physics. 407: 76-82. DOI: 10.1016/J.Chemphys.2012.09.001 |
0.82 |
|
2011 |
Lenz A, Kariis H, Pohl A, Persson P, Ojamäe L. The electronic structure and reflectivity of PEDOT:PSS from density functional theory Chemical Physics. 384: 44-51. DOI: 10.1016/J.Chemphys.2011.05.003 |
0.322 |
|
2009 |
Pal SK, Sundström V, Galoppini E, Persson P. Calculations of interfacial interactions in pyrene-Ipa rod sensitized nanostructured TiO2 Dalton Transactions. 10021-10031. PMID 19904429 DOI: 10.1039/B910880G |
0.578 |
|
2009 |
Thyagarajan S, Galoppini E, Persson P, Giaimuccio JM, Meyer GJ. Large footprint pyrene chromophores anchored to planar and colloidal metal oxide thin films. Langmuir : the Acs Journal of Surfaces and Colloids. 25: 9219-26. PMID 19719222 DOI: 10.1021/La9007679 |
0.321 |
|
2009 |
Abrahamsson M, Taratula O, Persson P, Galoppini E, Meyer GJ. Meta-substituted RuII rigid rods for sensitization of TiO2 Journal of Photochemistry and Photobiology a: Chemistry. 206: 155-163. DOI: 10.1016/J.Jphotochem.2009.06.002 |
0.451 |
|
2008 |
Abrahamsson M, Jäger M, Kumar RJ, Osterman T, Persson P, Becker HC, Johansson O, Hammarström L. Bistridentate ruthenium(II)polypyridyl-type complexes with microsecond 3MLCT state lifetimes: sensitizers for rod-like molecular arrays. Journal of the American Chemical Society. 130: 15533-42. PMID 19006410 DOI: 10.1021/Ja804890K |
0.821 |
|
2008 |
Borg OA, Godinho SS, Lundqvist MJ, Lunell S, Persson P. Computational study of the lowest triplet state of ruthenium polypyridyl complexes used in artificial photosynthesis. The Journal of Physical Chemistry. A. 112: 4470-6. PMID 18426189 DOI: 10.1021/Jp8000702 |
0.686 |
|
2008 |
Abrahamsson M, Lundqvist MJ, Wolpher H, Johansson O, Eriksson L, Bergquist J, Rasmussen T, Becker HC, Hammarström L, Norrby PO, Akermark B, Persson P. Steric influence on the excited-state lifetimes of ruthenium complexes with bipyridyl-alkanylene-pyridyl ligands. Inorganic Chemistry. 47: 3540-8. PMID 18402440 DOI: 10.1021/Ic7019457 |
0.527 |
|
2008 |
Li J, Nilsing M, Kondov I, Wang H, Persson P, Lunell S, Thoss M. Dynamical Simulation of Photoinduced Electron Transfer Reactions in Dye−Semiconductor Systems with Different Anchor Groups The Journal of Physical Chemistry C. 112: 12326-12333. DOI: 10.1021/Jp7118263 |
0.611 |
|
2008 |
Dietzek B, Brüggemann B, Persson P, Yartsev A. On the excited-state multi-dimensionality in cyanines Chemical Physics Letters. 455: 13-19. DOI: 10.1016/J.Cplett.2008.02.066 |
0.601 |
|
2008 |
Brüggemann B, Persson P, Meyer H, May V. Frequency dispersed transient absorption spectra of dissolved perylene: A case study using the density matrix version of the MCTDH method Chemical Physics. 347: 152-165. DOI: 10.1016/J.Chemphys.2007.11.001 |
0.346 |
|
2007 |
Hirani B, Li J, Djurovich PI, Yousufuddin M, Oxgaard J, Persson P, Wilson SR, Bau R, Goddard WA, Thompson ME. Cyclometallated iridium and platinum complexes with noninnocent ligands. Inorganic Chemistry. 46: 3865-75. PMID 17439204 DOI: 10.1021/Ic061556B |
0.529 |
|
2007 |
Lundqvist MJ, Galoppini E, Meyer GJ, Persson P. Calculated optoelectronic properties of ruthenium tris-bipyridine dyes containing oligophenyleneethynylene rigid rod linkers in different chemical environments. The Journal of Physical Chemistry. A. 111: 1487-97. PMID 17279731 DOI: 10.1021/Jp064219X |
0.392 |
|
2007 |
Wolpher H, Sinha S, Pan J, Johansson A, Lundqvist MJ, Persson P, Lomoth R, Bergquist J, Sun L, Sundström V, Akermark B, Polívka T. Synthesis and electron transfer studies of ruthenium-terpyridine-based dyads attached to nanostructured TiO2. Inorganic Chemistry. 46: 638-51. PMID 17257006 DOI: 10.1021/Ic060858A |
0.597 |
|
2007 |
Nilsing M, Persson P, Lunell S, Ojamäe L. Dye-sensitization of the TiO2 rutile (110) surface by perylene dyes : Quantum-chemical periodic B3LYP computations Journal of Physical Chemistry C. 111: 12116-12123. DOI: 10.1021/Jp072253L |
0.614 |
|
2007 |
Wolpher H, Sinha S, Pan J, Johansson A, Lundqvist MJ, Persson P, Lomoth R, Bergquist J, Sun L, Sundström V, Åkermark B, Polívka T. Synthesis and electron transfer studies of ruthenium-terpyridine-based dyads attached to nanostructured TiO2 Inorganic Chemistry. 46: 638-651. DOI: 10.1021/ic060858a |
0.494 |
|
2006 |
Persson P, Lundqvist MJ, Ernstorfer R, Iii WAG, Willig F. Quantum Chemical Calculations of the Influence of Anchor-Cum-Spacer Groups on Femtosecond Electron Transfer Times in Dye-Sensitized Semiconductor Nanocrystals. Journal of Chemical Theory and Computation. 2: 441-451. PMID 26626531 DOI: 10.1021/Ct050141X |
0.409 |
|
2006 |
Lundqvist MJ, Nilsing M, Lunell S, Akermark B, Persson P. Spacer and anchor effects on the electronic coupling in ruthenium-bis-terpyridine dye-sensitized TiO2 nanocrystals studied by DFT. The Journal of Physical Chemistry. B. 110: 20513-25. PMID 17034238 DOI: 10.1021/Jp064045J |
0.646 |
|
2006 |
Abrahamsson M, Jäger M, Osterman T, Eriksson L, Persson P, Becker HC, Johansson O, Hammarström L. A 3.0 micros room temperature excited state lifetime of a bistridentate RuII-polypyridine complex for rod-like molecular arrays. Journal of the American Chemical Society. 128: 12616-7. PMID 17002333 DOI: 10.1021/Ja064262Y |
0.805 |
|
2006 |
Borg OA, Liu YJ, Persson P, Lunell S, Karlsson D, Kadi M, Davidsson J. Photochemistry of bromofluorobenzenes. The Journal of Physical Chemistry. A. 110: 7045-56. PMID 16737252 DOI: 10.1021/Jp0600864 |
0.652 |
|
2006 |
Shiotani M, Persson P, Lunell S, Lund A, Williams F. Structures of tetrafluorocyclopropene, hexafluorocyclobutene, octafluorocyclopentene and related perfluoroalkene radical anions revealed by electron spin resonance spectroscopic and computational studies. The Journal of Physical Chemistry. A. 110: 6307-23. PMID 16686467 DOI: 10.1021/Jp0602427 |
0.516 |
|
2006 |
Persson P, Lundqvist M, Nilsing M, Duin ACTV, Iii WAG. Quantum-chemical calculations of dye-sensitized semiconductor nanocrystals Proceedings of Spie. 6325: 3250-3250. DOI: 10.1117/12.681717 |
0.385 |
|
2006 |
Goddard WA, Van Duin A, Chenoweth K, Cheng MJ, Pudar S, Oxgaard J, Merinov B, Jang YH, Persson P. Development of the ReaxFF reactive force field for mechanistic studies of catalytic selective oxidation processes on BiMoOx Topics in Catalysis. 38: 93-103. DOI: 10.1007/S11244-006-0074-X |
0.309 |
|
2006 |
Lundqvist MJ, Nilsing M, Persson P, Lunell S. DFT study of bare and dye-sensitized TiO2 clusters and nanocrystals International Journal of Quantum Chemistry. 106: 3214-3234. DOI: 10.1002/Qua.21088 |
0.577 |
|
2005 |
Persson P, Lundqvist MJ. Calculated structural and electronic interactions of the ruthenium dye N3 with a titanium dioxide nanocrystal. The Journal of Physical Chemistry. B. 109: 11918-24. PMID 16852468 DOI: 10.1021/Jp050513Y |
0.479 |
|
2005 |
Liu YJ, Lund A, Persson P, Lunell S. Density functional theory study of NO adsorbed in A-zeolite. The Journal of Physical Chemistry. B. 109: 7948-51. PMID 16851928 DOI: 10.1021/Jp044198B |
0.56 |
|
2005 |
Nilsing M, Lunell S, Persson P, Ojamäe L. Phosphonic acid adsorption at the TiO2 anatase (101) surface investigated by periodic hybrid HF-DFT computations, Surface Science. 582: 49-60. DOI: 10.1016/J.Susc.2005.02.044 |
0.589 |
|
2005 |
Nilsing M, Persson P, Ojamäe L. Anchor Group Influence on Molecule-Metal Oxide Interfaces: Periodic Hybrid DFT Study of Pyridine Bound to TiO2 via Carboxylic and Phosphonic Acid Chemical Physics Letters. 415: 375-380. DOI: 10.1016/J.Cplett.2005.08.154 |
0.368 |
|
2005 |
Komaguchi K, Norberg D, Nakazawa N, Shiotani M, Persson P, Lunell S. Direct ESR evidence for SH2 type reaction of methyl radical with methylsilane and methylgermane in a low temperature solid: A deuterium labeling study Chemical Physics Letters. 410: 1-5. DOI: 10.1016/J.Cplett.2005.04.091 |
0.52 |
|
2004 |
Liu YJ, Persson P, Lunell S. Multireference calculations of the phosphorescence and photodissociation of chlorobenzene. The Journal of Chemical Physics. 121: 11000-6. PMID 15634049 DOI: 10.1063/1.1810135 |
0.629 |
|
2004 |
Liu YJ, Persson P, Karlsson HO, Lunell S, Kadi M, Karlsson D, Davidsson J. Photodissociation of bromobenzene, dibromobenzene, and 1,3,5-tribromobenzene. The Journal of Chemical Physics. 120: 6502-9. PMID 15267540 DOI: 10.1063/1.1667460 |
0.615 |
|
2004 |
Liu Y, Persson P, Lunell * S. Theoretical study of the photodissociation of low lying excited states of hydrogen peroxide Molecular Physics. 102: 2575-2584. DOI: 10.1080/0026897042000274973 |
0.436 |
|
2004 |
Liu Y, Persson P, Lunell S. Theoretical Study of the Fast Photodissociation Channels of the Monohalobenzenes The Journal of Physical Chemistry A. 108: 2339-2345. DOI: 10.1021/Jp0379648 |
0.643 |
|
2003 |
Persson P, Gebhardt JCM, Lunell S. The Smallest Possible Nanocrystals of Semiionic Oxides Journal of Physical Chemistry B. 107: 3336-3339. DOI: 10.1021/Jp022036E |
0.569 |
|
2003 |
Schnadt J, Schiessling J, O'Shea JN, Gray SM, Patthey L, Johansson MKJ, Shi M, Krempaský J, Åhlund J, Karlsson PG, Persson P, Mårtensson N, Brühwiler PA. Structural study of adsorption of isonicotinic acid and related molecules on rutile TiO2(1 1 0) I: XAS and STM Surface Science. 540: 39-54. DOI: 10.1016/S0039-6028(03)00827-6 |
0.327 |
|
2003 |
Odelius M, Persson P, Lunell S. Bi-isonicotinic acid on rutile (1 1 0): calculated molecular and electronic structure Surface Science. 529: 47-58. DOI: 10.1016/S0039-6028(03)00020-7 |
0.626 |
|
2002 |
Schnadt J, Brühwiler PA, Patthey L, O'Shea JN, Södergren S, Odelius M, Ahuja R, Karis O, Bässler M, Persson P, Siegbahn H, Lunell S, Mårtensson N. Experimental evidence for sub-3-fs charge transfer from an aromatic adsorbate to a semiconductor. Nature. 418: 620-3. PMID 12167856 DOI: 10.1038/Nature00952 |
0.645 |
|
2002 |
Zimmerman C, Willig F, Ramakrishna S, Eichberger R, Ernstorfer R, Biswas N, Storck W, Persson P. Electronic coupling and coherence effects in ultrafast heterogeneous electron transfer Springer Series in Chemical Physics. 71: 328-330. DOI: 10.1364/Up.2002.Wd17 |
0.421 |
|
2002 |
Westermark K, Rensmo H, Siegbahn H, Keis K, Hagfeldt A, Ojamäe L, Persson P. PES Studies of Ru(dcbpyH2)2(NCS)2 Adsorption on Nanostructured ZnO for Solar Cell Applications Journal of Physical Chemistry B. 106: 10102-10107. DOI: 10.1021/Jp0142177 |
0.426 |
|
2002 |
Persson P, Bergström R, Ojamäe L, Lunell S. Quantum-chemical studies of metal oxides for photoelectrochemical applications Advances in Quantum Chemistry. 41: 203-263. DOI: 10.1016/S0065-3276(02)41054-4 |
0.594 |
|
2002 |
Persson P, Lunell S, Ojamäe L. Electronic interactions between aromatic adsorbates and metal oxide substrates calculated from first principles Chemical Physics Letters. 364: 469-474. DOI: 10.1016/S0009-2614(02)01370-2 |
0.625 |
|
2002 |
Persson P, Lunell S, Ojamäe L. Quantum chemical prediction of the adsorption conformations and dynamics at HCOOH-covered ZnO(1010) surfaces International Journal of Quantum Chemistry. 89: 172-180. DOI: 10.1002/Qua.10316 |
0.585 |
|
2001 |
Persson P, Lunell S, Szöke A, Ziaja B, Hajdu J. Shake-up and shake-off excitations with associated electron losses in X-ray studies of proteins. Protein Science : a Publication of the Protein Society. 10: 2480-4. PMID 11714915 DOI: 10.1110/Ps.Ps.26201 |
0.621 |
|
2001 |
Westermark K, Tingry S, Persson P, Rensmo H, Lunell S, Hagfeldt A, Siegbahn H. Triarylamine on nanocrystalline TiO2 studied in its reduced and oxidized state by photoelectron spectroscopy Journal of Physical Chemistry B. 105: 7182-7187. DOI: 10.1021/Jp003924H |
0.641 |
|
2000 |
Persson P, Lunell S, Brühwiler PA, Schnadt J, Södergren S, O’Shea JN, Karis O, Siegbahn H, Mårtensson N, Bässler M, Patthey L. N 1s x-ray absorption study of the bonding interaction of bi-isonicotinic acid adsorbed on rutile TiO2(110) The Journal of Chemical Physics. 112: 3945-3948. DOI: 10.1063/1.480945 |
0.595 |
|
2000 |
Persson P, Bergström R, Lunell S. Quantum Chemical Study of Photoinjection Processes in Dye-Sensitized TiO2 Nanoparticles Journal of Physical Chemistry B. 104: 10348-10351. DOI: 10.1021/Jp002550P |
0.641 |
|
2000 |
Persson P, Lunell S. Binding of bi-isonicotinic acid to anatase TiO2 (101) Solar Energy Materials and Solar Cells. 63: 139-148. DOI: 10.1016/S0927-0248(99)00169-5 |
0.58 |
|
2000 |
Persson P, Ojamäe L. Periodic Hartree–Fock study of the adsorption of formic acid on ZnO(1010) Chemical Physics Letters. 321: 302-308. DOI: 10.1016/S0009-2614(00)00347-X |
0.326 |
|
2000 |
Persson P, Bustad J, Zerner MC. INDO Calculations of Small Copper Clusters and CO Adsorbed on Copper(100) Surfaces Journal of Computational Chemistry. 21: 1221-1228. DOI: 10.1002/1096-987X(20001115)21:14<1221::Aid-Jcc1>3.0.Co;2-# |
0.343 |
|
1999 |
Nakayama Y, Persson P, Lunell S, Kowalczyk SP, Wannberg B, Gelius U. High Resolution X-Ray Photoelectron Spectroscopy and INDO/S-CI Study of the Core Electron Shakeup States of PMDA-ODA Polyimide Journal of Vacuum Science and Technology. 17: 2791-2799. DOI: 10.1116/1.581946 |
0.589 |
|
1999 |
Rensmo H, Westermark K, Södergren S, Kohle O, Persson P, Lunell S, Siegbahn H. XPS studies of Ru-polypyridine complexes for solar cell applications Journal of Chemical Physics. 111: 2744-2750. DOI: 10.1063/1.479551 |
0.676 |
|
1999 |
Patthey L, Rensmo H, Persson P, Westermark K, Vayssieres L, Stashans A, Petersson A, Bruhwiler PA, Siegbahn H, Lunell S, Mårtensson N. Adsorption of bi-isonicotinic acid on rutile TiO2(110) Journal of Chemical Physics. 110: 5913-5918. DOI: 10.1063/1.478491 |
0.602 |
|
1998 |
Persson P, Stashans A, Bergström R, Lunell S. Periodic INDO calculations of organic adsorbates on a TiO2 surface International Journal of Quantum Chemistry. 70: 1055-1066. DOI: 10.1002/(Sici)1097-461X(1998)70:4/5<1055::Aid-Qua53>3.0.Co;2-0 |
0.585 |
|
1996 |
Sorensen SL, Osborne SJ, Ausmees A, Kikas A, Correia N, Svensson S, Naves de Brito A, Persson P, Lunell S. Site‐selective participator decay of core‐excited butadiene The Journal of Chemical Physics. 105: 10719-10724. DOI: 10.1063/1.472874 |
0.646 |
|
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