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Items: 1 to 50 of 67

1.

Unraveling the thermodynamic criteria for size-dependent spontaneous phase separation in soft porous crystals.

Rogge SMJ, Waroquier M, Van Speybroeck V.

Nat Commun. 2019 Oct 24;10(1):4842. doi: 10.1038/s41467-019-12754-w.

2.

Thermal unequilibrium of strained black CsPbI3 thin films.

Steele JA, Jin H, Dovgaliuk I, Berger RF, Braeckevelt T, Yuan H, Martin C, Solano E, Lejaeghere K, Rogge SMJ, Notebaert C, Vandezande W, Janssen KPF, Goderis B, Debroye E, Wang YK, Dong Y, Ma D, Saidaminov M, Tan H, Lu Z, Dyadkin V, Chernyshov D, Van Speybroeck V, Sargent EH, Hofkens J, Roeffaers MBJ.

Science. 2019 Aug 16;365(6454):679-684. doi: 10.1126/science.aax3878. Epub 2019 Jul 25.

PMID:
31346140
3.

Single Rare-Earth Ions as Atomic-Scale Probes in Ultrascaled Transistors.

Zhang Q, Hu G, de Boo GG, Rančić M, Johnson BC, McCallum JC, Du J, Sellars MJ, Yin C, Rogge S.

Nano Lett. 2019 Aug 14;19(8):5025-5030. doi: 10.1021/acs.nanolett.9b01281. Epub 2019 Jul 3.

PMID:
31251075
4.

On the importance of anharmonicities and nuclear quantum effects in modelling the structural properties and thermal expansion of MOF-5.

Lamaire A, Wieme J, Rogge SMJ, Waroquier M, Van Speybroeck V.

J Chem Phys. 2019 Mar 7;150(9):094503. doi: 10.1063/1.5085649.

PMID:
30849909
5.

Readout and control of the spin-orbit states of two coupled acceptor atoms in a silicon transistor.

van der Heijden J, Kobayashi T, House MG, Salfi J, Barraud S, Laviéville R, Simmons MY, Rogge S.

Sci Adv. 2018 Dec 7;4(12):eaat9199. doi: 10.1126/sciadv.aat9199. eCollection 2018 Dec.

6.

Protocol for Identifying Accurate Collective Variables in Enhanced Molecular Dynamics Simulations for the Description of Structural Transformations in Flexible Metal-Organic Frameworks.

Demuynck R, Wieme J, Rogge SMJ, Dedecker KD, Vanduyfhuys L, Waroquier M, Van Speybroeck V.

J Chem Theory Comput. 2018 Nov 13;14(11):5511-5526. doi: 10.1021/acs.jctc.8b00725. Epub 2018 Nov 5.

7.

Gigahertz Single-Electron Pumping Mediated by Parasitic States.

Rossi A, Klochan J, Timoshenko J, Hudson FE, Möttönen M, Rogge S, Dzurak AS, Kashcheyevs V, Tettamanzi GC.

Nano Lett. 2018 Jul 11;18(7):4141-4147. doi: 10.1021/acs.nanolett.8b00874. Epub 2018 Jun 26.

PMID:
29916248
8.

Elucidating the Vibrational Fingerprint of the Flexible Metal-Organic Framework MIL-53(Al) Using a Combined Experimental/Computational Approach.

Hoffman AEJ, Vanduyfhuys L, Nevjestić I, Wieme J, Rogge SMJ, Depauw H, Van Der Voort P, Vrielinck H, Van Speybroeck V.

J Phys Chem C Nanomater Interfaces. 2018 Feb 8;122(5):2734-2746. doi: 10.1021/acs.jpcc.7b11031. Epub 2018 Jan 8.

9.

The Importance of Cell Shape Sampling To Accurately Predict Flexibility in Metal-Organic Frameworks.

Rogge SMJ, Caroes S, Demuynck R, Waroquier M, Van Speybroeck V, Ghysels A.

J Chem Theory Comput. 2018 Mar 13;14(3):1186-1197. doi: 10.1021/acs.jctc.7b01134. Epub 2018 Mar 5.

PMID:
29444398
10.

Down-regulation of respiration in pear fruit depends on temperature.

Ho QT, Hertog MLATM, Verboven P, Ambaw A, Rogge S, Verlinden BE, Nicolaï BM.

J Exp Bot. 2018 Apr 9;69(8):2049-2060. doi: 10.1093/jxb/ery031.

11.

Thermodynamic insight into stimuli-responsive behaviour of soft porous crystals.

Vanduyfhuys L, Rogge SMJ, Wieme J, Vandenbrande S, Maurin G, Waroquier M, Van Speybroeck V.

Nat Commun. 2018 Jan 15;9(1):204. doi: 10.1038/s41467-017-02666-y.

12.

Influence of a Confined Methanol Solvent on the Reactivity of Active Sites in UiO-66.

Caratelli C, Hajek J, Rogge SMJ, Vandenbrande S, Meijer EJ, Waroquier M, Van Speybroeck V.

Chemphyschem. 2018 Feb 19;19(4):420-429. doi: 10.1002/cphc.201701109. Epub 2018 Jan 9.

13.

Reliably Modeling the Mechanical Stability of Rigid and Flexible Metal-Organic Frameworks.

Rogge SMJ, Waroquier M, Van Speybroeck V.

Acc Chem Res. 2018 Jan 16;51(1):138-148. doi: 10.1021/acs.accounts.7b00404. Epub 2017 Nov 20.

14.

Efficient Construction of Free Energy Profiles of Breathing Metal-Organic Frameworks Using Advanced Molecular Dynamics Simulations.

Demuynck R, Rogge SMJ, Vanduyfhuys L, Wieme J, Waroquier M, Van Speybroeck V.

J Chem Theory Comput. 2017 Dec 12;13(12):5861-5873. doi: 10.1021/acs.jctc.7b01014. Epub 2017 Dec 1.

15.

Towards visualisation of central-cell-effects in scanning tunnelling microscope images of subsurface dopant qubits in silicon.

Usman M, Voisin B, Salfi J, Rogge S, Hollenberg LCL.

Nanoscale. 2017 Nov 9;9(43):17013-17019. doi: 10.1039/c7nr05081j.

PMID:
29082402
16.

Implementation of Multivariable Logic Functions in Parallel by Electrically Addressing a Molecule of Three Dopants in Silicon.

Fresch B, Bocquel J, Hiluf D, Rogge S, Levine RD, Remacle F.

Chemphyschem. 2017 Jul 5;18(13):1790-1797. doi: 10.1002/cphc.201700222. Epub 2017 May 29.

PMID:
28470997
17.

Probing the Quantum States of a Single Atom Transistor at Microwave Frequencies.

Tettamanzi GC, Hile SJ, House MG, Fuechsle M, Rogge S, Simmons MY.

ACS Nano. 2017 Mar 28;11(3):2444-2451. doi: 10.1021/acsnano.6b06362. Epub 2016 Nov 17. Erratum in: ACS Nano. 2017 Mar 28;11(3):3420.

18.

Metal-organic and covalent organic frameworks as single-site catalysts.

Rogge SMJ, Bavykina A, Hajek J, Garcia H, Olivos-Suarez AI, Sepúlveda-Escribano A, Vimont A, Clet G, Bazin P, Kapteijn F, Daturi M, Ramos-Fernandez EV, Llabrés I Xamena FX, Van Speybroeck V, Gascon J.

Chem Soc Rev. 2017 Jun 6;46(11):3134-3184. doi: 10.1039/c7cs00033b. Review.

19.

Dynamics of a single-atom electron pump.

van der Heijden J, Tettamanzi GC, Rogge S.

Sci Rep. 2017 Mar 15;7:44371. doi: 10.1038/srep44371.

20.

Correction to Probing the Quantum States of a Single Atom Transistor at Microwave Frequencies.

Tettamanzi GC, Hile SJ, House MG, Fuechsle M, Rogge S, Simmons MY.

ACS Nano. 2017 Mar 28;11(3):3420. doi: 10.1021/acsnano.6b08154. Epub 2017 Feb 27. No abstract available.

21.

A Probabilistic Finite State Logic Machine Realized Experimentally on a Single Dopant Atom.

Fresch B, Bocquel J, Rogge S, Levine RD, Remacle F.

Nano Lett. 2017 Mar 8;17(3):1846-1852. doi: 10.1021/acs.nanolett.6b05149. Epub 2017 Feb 21.

PMID:
28211693
22.

Thermodynamic Insight in the High-Pressure Behavior of UiO-66: Effect of Linker Defects and Linker Expansion.

Rogge SM, Wieme J, Vanduyfhuys L, Vandenbrande S, Maurin G, Verstraelen T, Waroquier M, Van Speybroeck V.

Chem Mater. 2016 Aug 23;28(16):5721-5732. Epub 2016 Jul 25.

23.

Acidity Constant (pKa ) Calculation of Large Solvated Dye Molecules: Evaluation of Two Advanced Molecular Dynamics Methods.

De Meyer T, Ensing B, Rogge SM, De Clerck K, Meijer EJ, Van Speybroeck V.

Chemphyschem. 2016 Nov 4;17(21):3447-3459. doi: 10.1002/cphc.201600734. Epub 2016 Sep 30.

24.

Exploring the Flexibility of MIL-47(V)-Type Materials Using Force Field Molecular Dynamics Simulations.

Wieme J, Vanduyfhuys L, Rogge SMJ, Waroquier M, Van Speybroeck V.

J Phys Chem C Nanomater Interfaces. 2016 Jul 14;120(27):14934-14947. doi: 10.1021/acs.jpcc.6b04422. Epub 2016 Jun 13.

25.

Charge-Insensitive Single-Atom Spin-Orbit Qubit in Silicon.

Salfi J, Mol JA, Culcer D, Rogge S.

Phys Rev Lett. 2016 Jun 17;116(24):246801. doi: 10.1103/PhysRevLett.116.246801. Epub 2016 Jun 14.

PMID:
27367400
26.

Spatial metrology of dopants in silicon with exact lattice site precision.

Usman M, Bocquel J, Salfi J, Voisin B, Tankasala A, Rahman R, Simmons MY, Rogge S, Hollenberg LC.

Nat Nanotechnol. 2016 Sep;11(9):763-8. doi: 10.1038/nnano.2016.83. Epub 2016 Jun 6.

PMID:
27271965
27.

Quantum computing with acceptor spins in silicon.

Salfi J, Tong M, Rogge S, Culcer D.

Nanotechnology. 2016 Jun 17;27(24):244001. doi: 10.1088/0957-4484/27/24/244001. Epub 2016 May 11.

PMID:
27171901
28.

Quantum simulation of the Hubbard model with dopant atoms in silicon.

Salfi J, Mol JA, Rahman R, Klimeck G, Simmons MY, Hollenberg LC, Rogge S.

Nat Commun. 2016 Apr 20;7:11342. doi: 10.1038/ncomms11342.

29.

A Comparison of Barostats for the Mechanical Characterization of Metal-Organic Frameworks.

Rogge SM, Vanduyfhuys L, Ghysels A, Waroquier M, Verstraelen T, Maurin G, Van Speybroeck V.

J Chem Theory Comput. 2015 Dec 8;11(12):5583-97. doi: 10.1021/acs.jctc.5b00748. Epub 2015 Nov 12.

PMID:
26642981
30.

A surface code quantum computer in silicon.

Hill CD, Peretz E, Hile SJ, House MG, Fuechsle M, Rogge S, Simmons MY, Hollenberg LC.

Sci Adv. 2015 Oct 30;1(9):e1500707. doi: 10.1126/sciadv.1500707. eCollection 2015 Oct.

31.

Radio frequency measurements of tunnel couplings and singlet-triplet spin states in Si:P quantum dots.

House MG, Kobayashi T, Weber B, Hile SJ, Watson TF, van der Heijden J, Rogge S, Simmons MY.

Nat Commun. 2015 Nov 9;6:8848. doi: 10.1038/ncomms9848.

32.

Plasmodium falciparum malaria occurring four years after leaving an endemic area.

Vantomme B, Van Acker J, Rogge S, Ommeslag D, Donck J, Callens S.

Acta Clin Belg. 2016 Apr;71(2):111-3. doi: 10.1179/2295333715Y.0000000063. Epub 2016 Feb 9.

PMID:
26312505
33.

Donor hyperfine Stark shift and the role of central-cell corrections in tight-binding theory.

Usman M, Rahman R, Salfi J, Bocquel J, Voisin B, Rogge S, Klimeck G, Hollenberg LL.

J Phys Condens Matter. 2015 Apr 22;27(15):154207. doi: 10.1088/0953-8984/27/15/154207. Epub 2015 Mar 18.

PMID:
25783758
34.

Spatially resolved resonant tunneling on single atoms in silicon.

Voisin B, Salfi J, Bocquel J, Rahman R, Rogge S.

J Phys Condens Matter. 2015 Apr 22;27(15):154203. doi: 10.1088/0953-8984/27/15/154203. Epub 2015 Mar 18.

PMID:
25782866
35.

Single dopants in semiconductors.

Schofield SR, Rogge S.

J Phys Condens Matter. 2015 Apr 22;27(15):150301. doi: 10.1088/0953-8984/27/15/150301. Epub 2015 Mar 18. No abstract available.

PMID:
25782475
36.

Cutaneous infection by Alternaria infectoria in a liver transplant recipient: a case report.

Coussens E, Rogge S, Haspeslagh M, Geerts A, Verhelst X, Van Vlierberghe H, Troisi RI, Colle I.

Acta Gastroenterol Belg. 2014 Jun;77(2):256-8.

PMID:
25090825
37.

An accurate single-electron pump based on a highly tunable silicon quantum dot.

Rossi A, Tanttu T, Tan KY, Iisakka I, Zhao R, Chan KW, Tettamanzi GC, Rogge S, Dzurak AS, Möttönen M.

Nano Lett. 2014 Jun 11;14(6):3405-11. doi: 10.1021/nl500927q. Epub 2014 May 19.

PMID:
24823277
38.

Spatially resolving valley quantum interference of a donor in silicon.

Salfi J, Mol JA, Rahman R, Klimeck G, Simmons MY, Hollenberg LC, Rogge S.

Nat Mater. 2014 Jun;13(6):605-10. doi: 10.1038/nmat3941. Epub 2014 Apr 6.

PMID:
24705384
39.

Probing the spin states of a single acceptor atom.

van der Heijden J, Salfi J, Mol JA, Verduijn J, Tettamanzi GC, Hamilton AR, Collaert N, Rogge S.

Nano Lett. 2014 Mar 12;14(3):1492-6. doi: 10.1021/nl4047015. Epub 2014 Mar 3.

PMID:
24571637
40.

Quantum computing: atomic clocks in the solid state.

Rogge S, Sellars MJ.

Nat Nanotechnol. 2013 Aug;8(8):544-5. doi: 10.1038/nnano.2013.152. No abstract available.

PMID:
23912104
41.

Optical addressing of an individual erbium ion in silicon.

Yin C, Rancic M, de Boo GG, Stavrias N, McCallum JC, Sellars MJ, Rogge S.

Nature. 2013 May 2;497(7447):91-4. doi: 10.1038/nature12081.

PMID:
23636400
42.

Wave function control over a single donor atom.

Verduijn J, Tettamanzi GC, Rogge S.

Nano Lett. 2013 Apr 10;13(4):1476-80. doi: 10.1021/nl304518v. Epub 2013 Mar 26.

PMID:
23514349
43.

Few electron limit of n-type metal oxide semiconductor single electron transistors.

Prati E, De Michielis M, Belli M, Cocco S, Fanciulli M, Kotekar-Patil D, Ruoff M, Kern DP, Wharam DA, Verduijn J, Tettamanzi GC, Rogge S, Roche B, Wacquez R, Jehl X, Vinet M, Sanquer M.

Nanotechnology. 2012 Jun 1;23(21):215204. doi: 10.1088/0957-4484/23/21/215204.

PMID:
22552118
44.

Magnetic-field probing of an SU(4) Kondo resonance in a single-atom transistor.

Tettamanzi GC, Verduijn J, Lansbergen GP, Blaauboer M, Calderón MJ, Aguado R, Rogge S.

Phys Rev Lett. 2012 Jan 27;108(4):046803. Epub 2012 Jan 25.

PMID:
22400874
45.

Lifetime-enhanced transport in silicon due to spin and valley blockade.

Lansbergen GP, Rahman R, Verduijn J, Tettamanzi GC, Collaert N, Biesemans S, Klimeck G, Hollenberg LC, Rogge S.

Phys Rev Lett. 2011 Sep 23;107(13):136602. Epub 2011 Sep 19. Erratum in: Phys Rev Lett. 2013 Jan 25;110(4):049901.

PMID:
22026881
46.

Single-electron capacitance spectroscopy of individual dopants in silicon.

Gasseller M, DeNinno M, Loo R, Harrison JF, Caymax M, Rogge S, Tessmer SH.

Nano Lett. 2011 Dec 14;11(12):5208-12. doi: 10.1021/nl2025163. Epub 2011 Oct 31.

PMID:
22022859
47.

Integrated logic circuits using single-atom transistors.

Mol JA, Verduijn J, Levine RD, Remacle F, Rogge S.

Proc Natl Acad Sci U S A. 2011 Aug 23;108(34):13969-72. doi: 10.1073/pnas.1109935108. Epub 2011 Aug 1.

48.

Compact Mach-Zehnder interferometer based on self-collimation of light in a silicon photonic crystal.

Nguyen HM, Dundar MA, van der Heijden RW, van der Drift EW, Salemink HW, Rogge S, Caro J.

Opt Express. 2010 Mar 29;18(7):6437-46. doi: 10.1364/OE.18.006437.

PMID:
20389667
49.

Nanoelectronics: single dopants learn their place.

Rogge S.

Nat Nanotechnol. 2010 Feb;5(2):100-1. doi: 10.1038/nnano.2010.11. No abstract available.

PMID:
20130587
50.

Tunable Kondo effect in a single donor atom.

Lansbergen GP, Tettamanzi GC, Verduijn J, Collaert N, Biesemans S, Blaauboer M, Rogge S.

Nano Lett. 2010 Feb 10;10(2):455-60. doi: 10.1021/nl9031132.

PMID:
20041698

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