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30 Publications
2017 | Published | Journal Article | IST-REx-ID: 17945
Temperature dependent tunneling conductance of single molecule junctions
M. Kamenetska, J.R. Widawsky, M. Dell’Angela, M. Frei, L. Venkataraman, The Journal of Chemical Physics 146 (2017).
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M. Kamenetska, J.R. Widawsky, M. Dell’Angela, M. Frei, L. Venkataraman, The Journal of Chemical Physics 146 (2017).
2017 | Published | Journal Article | IST-REx-ID: 17944
Preface: Special topic on Frontiers in Molecular Scale Electronics
F. Evers, L. Venkataraman, The Journal of Chemical Physics 146 (2017).
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F. Evers, L. Venkataraman, The Journal of Chemical Physics 146 (2017).
2017 | Published | Journal Article | IST-REx-ID: 9660 | 
The Gibbs free energy of homogeneous nucleation: From atomistic nuclei to the planar limit
B. Cheng, G.A. Tribello, M. Ceriotti, The Journal of Chemical Physics 147 (2017).
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B. Cheng, G.A. Tribello, M. Ceriotti, The Journal of Chemical Physics 147 (2017).
2017 | Published | Journal Article | IST-REx-ID: 9661 |
Bridging the gap between atomistic and macroscopic models of homogeneous nucleation
B. Cheng, M. Ceriotti, The Journal of Chemical Physics 146 (2017).
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B. Cheng, M. Ceriotti, The Journal of Chemical Physics 146 (2017).
2016 | Published | Journal Article | IST-REx-ID: 10376 |
Kinetics of spontaneous filament nucleation via oligomers: Insights from theory and simulation
A. Šarić, T.C.T. Michaels, A. Zaccone, T.P.J. Knowles, D. Frenkel, The Journal of Chemical Physics 145 (2016).
[Preprint]
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A. Šarić, T.C.T. Michaels, A. Zaccone, T.P.J. Knowles, D. Frenkel, The Journal of Chemical Physics 145 (2016).
2016 | Published | Journal Article | IST-REx-ID: 10380 |
Non-equilibrium simulations of thermally induced electric fields in water
P. Wirnsberger, D. Fijan, A. Šarić, M. Neumann, C. Dellago, D. Frenkel, The Journal of Chemical Physics 144 (2016).
[Preprint]
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P. Wirnsberger, D. Fijan, A. Šarić, M. Neumann, C. Dellago, D. Frenkel, The Journal of Chemical Physics 144 (2016).
2014 | Published | Journal Article | IST-REx-ID: 14019
The cyclopropene radical cation: Rovibrational level structure at low energies from high-resolution photoelectron spectra
K. Vasilatou, J.M. Michaud, D.R. Baykusheva, G. Grassi, F. Merkt, The Journal of Chemical Physics 141 (2014).
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K. Vasilatou, J.M. Michaud, D.R. Baykusheva, G. Grassi, F. Merkt, The Journal of Chemical Physics 141 (2014).
2014 | Published | Journal Article | IST-REx-ID: 9662 |
Direct path integral estimators for isotope fractionation ratios
B. Cheng, M. Ceriotti, The Journal of Chemical Physics 141 (2014).
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B. Cheng, M. Ceriotti, The Journal of Chemical Physics 141 (2014).
2013 | Published | Journal Article | IST-REx-ID: 17991 |
Transport properties of individual C60-molecules
G. Géranton, C. Seiler, A. Bagrets, L. Venkataraman, F. Evers, The Journal of Chemical Physics 139 (2013).
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G. Géranton, C. Seiler, A. Bagrets, L. Venkataraman, F. Evers, The Journal of Chemical Physics 139 (2013).
2013 | Published | Journal Article | IST-REx-ID: 9663 |
Thermally induced solid-solid structural transition of copper nanoparticles through direct geometrical conversion
B. Cheng, A.H.W. Ngan, The Journal of Chemical Physics 138 (2013).
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B. Cheng, A.H.W. Ngan, The Journal of Chemical Physics 138 (2013).