| Year |
Citation |
Score |
| 2023 |
Schaack S, Mangaud E, Fallacara E, Huppert S, Depondt P, Finocchi F. When Quantum Fluctuations Meet Structural Instabilities: The Isotope- and Pressure-Induced Phase Transition in the Quantum Paraelectric NaOH. Physical Review Letters. 131: 126101. PMID 37802932 DOI: 10.1103/PhysRevLett.131.126101 |
0.418 |
|
| 2023 |
Maillard L, Finocchi F, Trassinelli M. Assessing Search and Unsupervised Clustering Algorithms in Nested Sampling. Entropy (Basel, Switzerland). 25. PMID 36832713 DOI: 10.3390/e25020347 |
0.323 |
|
| 2022 |
Cazzaniga M, Micciarelli M, Gabas F, Finocchi F, Ceotto M. Quantum Anharmonic Calculations of Vibrational Spectra for Water Adsorbed on Titania Anatase(101) Surface: Dissociative versus Molecular Adsorption. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 126: 12060-12073. PMID 35928238 DOI: 10.1021/acs.jpcc.2c02137 |
0.337 |
|
| 2021 |
Fallacara E, Depondt P, Huppert S, Ceotto M, Finocchi F. Thermal and Nuclear Quantum Effects at the Antiferroelectric to Paraelectric Phase Transition in KOH and KOD Crystals. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 125: 22328-22334. PMID 35082961 DOI: 10.1021/acs.jpcc.1c06953 |
0.335 |
|
| 2021 |
Plé T, Huppert S, Finocchi F, Depondt P, Bonella S. Anharmonic spectral features via trajectory-based quantum dynamics: A perturbative analysis of the interplay between dynamics and sampling. The Journal of Chemical Physics. 155: 104108. PMID 34525824 DOI: 10.1063/5.0056824 |
0.617 |
|
| 2019 |
Plé T, Huppert S, Finocchi F, Depondt P, Bonella S. Sampling the thermal Wigner density via a generalized Langevin dynamics. The Journal of Chemical Physics. 151: 114114. PMID 31542021 DOI: 10.1063/1.5099246 |
0.602 |
|
| 2019 |
Mangaud E, Huppert S, Plé T, Depondt P, Bonella S, Finocchi F. The Fluctuation-Dissipation Theorem as a Diagnosis and Cure for Zero-Point Energy Leakage in Quantum Thermal Bath Simulations. Journal of Chemical Theory and Computation. PMID 30939002 DOI: 10.1021/acs.jctc.8b01164 |
0.611 |
|
| 2017 |
Bronstein Y, Depondt P, Finocchi F. Thermal and nuclear quantum effects in the hydrogen bond dynamical symmetrization phase transition of δ-AlOOH European Journal of Mineralogy. 29: 385-395. DOI: 10.1127/EJM/2017/0029-2628 |
0.398 |
|
| 2016 |
Brieuc F, Bronstein Y, Dammak H, Depondt P, Finocchi F, Hayoun M. Zero-Point Energy Leakage in Quantum Thermal Bath Molecular Dynamics Simulations. Journal of Chemical Theory and Computation. 12: 5688-5697. PMID 27766830 DOI: 10.1021/acs.jctc.6b00684 |
0.527 |
|
| 2016 |
Bronstein Y, Depondt P, Bove LE, Gaal R, Saitta AM, Finocchi F. Quantum versus classical protons in pure and salty ice under pressure Physical Review B. 93. DOI: 10.1103/PHYSREVB.93.024104 |
0.317 |
|
| 2014 |
Bronstein Y, Depondt P, Finocchi F, Saitta AM. Quantum-driven phase transition in ice described via an efficient Langevin approach Physical Review B. 89. DOI: 10.1103/PHYSREVB.89.214101 |
0.362 |
|
| 2012 |
Dammak H, Antoshchenkova E, Hayoun M, Finocchi F. Isotope effects in lithium hydride and lithium deuteride crystals by molecular dynamics simulations. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 24: 435402. PMID 23034812 DOI: 10.1088/0953-8984/24/43/435402 |
0.478 |
|
| 2012 |
Dammak H, Antoshchenkova E, Hayoun M, Finocchi F. Isotope effects in lithium hydride and lithium deuteride crystals by molecular dynamics simulations. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 24: 435402. PMID 23034812 DOI: 10.1088/0953-8984/24/43/435402 |
0.478 |
|
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