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LSM Publication List (since 2018)

Davies U, Margulis M, Shwageraus E, Fridman E, Garcia-Herranz N, Jimenez-Carrascosa A, et al.
Evaluation of the ESFR end of cycle state and detailed analysis of spatial distributions of reactivity coefficients
In: Margulis M, Blaise P, eds. PHYSOR2020 - international conference on physics of reactors: transition to a scalable nuclear future. Vol. 247. EPJ web of conferences. Les Ulis Cedex A: EDP Sciences; 2021:02001 (10 pp.). https://doi.org/10.1051/epjconf/202124702001
DORA PSI
Dehbi A
A correlation spanning the entire laminar convection regime for vapor condensation over a horizontal tube in the presence of a noncondensable gas
International Communications in Heat and Mass Transfer. 2021; 128: 105619 (12 pp.). https://doi.org/10.1016/j.icheatmasstransfer.2021.105619
DORA PSI
Dehbi A
Correcting for tube curvature effects on condensation in the presence of a noncondensable gas in turbulent free convection
International Journal of Heat and Mass Transfer. 2021; 164: 120594 (11 pp.). https://doi.org/10.1016/j.ijheatmasstransfer.2020.120594
DORA PSI
Dehbi A
Development of a general correlation for free convection vapor condensation over a horizontal tube in the presence of a noncondensable gas
International Journal of Heat and Mass Transfer. 2021; 123: 105210 (13 pp.). https://doi.org/10.1016/j.icheatmasstransfer.2021.105210
DORA PSI
Delley B, van den Bergh F
Fast full-field modulation transfer function analysis for photographic lens quality assessment
Applied Optics. 2021; 60(8): 2197-2206. https://doi.org/10.1364/AO.415974
DORA PSI
Derlet PM, Maaß R
Micro-plasticity in a fragile model binary glass
Acta Materialia. 2021; 209: 116771 (12 pp.). https://doi.org/10.1016/j.actamat.2021.116771
DORA PSI
Di Nora VA, Fridman E, Nikitin E, Bilodid Y, Mikityuk K
Optimization of multi-group energy structures for diffusion analyses of sodium-cooled fast reactors assisted by simulated annealing - part I: methodology demonstration
Annals of Nuclear Energy. 2021; 155: 108183 (9 pp.). https://doi.org/10.1016/j.anucene.2021.108183
DORA PSI
Di Nora VA, Fridman E, Nikitin E, Bilodid Y, Mikityuk K
Optimization of multi-group energy structures for diffusion analyses of sodium-cooled fast reactors assisted by simulated annealing - part II: methodology application
Annals of Nuclear Energy. 2021; 163: 108541 (9 pp.). https://doi.org/10.1016/j.anucene.2021.108541
DORA PSI
Grimm M, Beckert A, Aeppli G, Müller M
Universal quantum computing using electronuclear wavefunctions of rare-earth ions
PRX Quantum. 2021; 2(1): 010312 (19 pp.). https://doi.org/10.1103/PRXQuantum.2.010312
DORA PSI
Guidez J, Gerschenfeld A, Bodi J, Mikityuk K, Alvarez-Velarde F, Romojaro P, et al.
ESFR smart project conceptual design of in-vessel core catcher
In: Margulis M, Blaise P, eds. PHYSOR2020 - international conference on physics of reactors: transition to a scalable nuclear future. Vol. 247. EPJ web of conferences. Les Ulis Cedex A: EDP Sciences; 2021:01002 (7 pp.). https://doi.org/10.1051/epjconf/202124701002
DORA PSI
Hadžiabdić M, Borrelli M, Ničeno B
Simulation of Rayleigh-Benárd convection at up to Ra = 10¹⁶ by generalized elliptic-relaxation hybrid RANS-LES model
International Journal of Heat and Fluid Flow. 2021; 90: 108819 (13 pp.). https://doi.org/10.1016/j.ijheatfluidflow.2021.108819
DORA PSI
Isaikina P, Tsai C-J, Dietz N, Pamula F, Grahl A, Goldie KN, et al.
Structural basis of the activation of the CC chemokine receptor 5 by a chemokine agonist
Science Advances. 2021; 7(25): eabg8685 (11 pp.). https://doi.org/10.1126/sciadv.abg8685
DORA PSI
Karalis K, Zahn D, Prasianakis NI, Niceno B, Churakov SV
Deciphering the molecular mechanism of water boiling at heterogeneous interfaces
Scientific Reports. 2021; 11(1): 19858 (10 pp.). https://doi.org/10.1038/s41598-021-99229-5
DORA PSI
Karpov P, Verdel R, Huang Y-P, Schmitt M, Heyl M
Disorder-free localization in an interacting 2D lattice gauge theory
Physical Review Letters. 2021; 126(13): 130401 (6 pp.). https://doi.org/10.1103/PhysRevLett.126.130401
DORA PSI
Khatoonabadi M, Safi MA, Prasianakis NI, Roth J, Mantzaras J, Kirov N, et al.
Insights on the interaction of serpentine channels and gas diffusion layer in an operating polymer electrolyte fuel cell: numerical modeling across scales
International Journal of Heat and Mass Transfer. 2021; 181: 121859 (13 pp.). https://doi.org/10.1016/j.ijheatmasstransfer.2021.121859
DORA PSI
Khatoonabadi M, Prasianakis NI, Mantzaras J
Lattice Boltzmann model with generalized wall boundary conditions for arbitrary catalytic reactivity
Physical Review E. 2021; 103(6): 063303 (13 pp.). https://doi.org/10.1103/PhysRevE.103.063303
DORA PSI
Koklič T, Hrovat A, Guixà-González R, Rodríguez-Espigares I, Navio D, Frangež R, et al.
Electron paramagnetic resonance gives evidence for the presence of type 1 gonadotropin-releasing hormone receptor (GnRH-R) in subdomains of lipid rafts
Molecules. 2021; 26(4): 973 (17 pp.). https://doi.org/10.3390/molecules26040973
DORA PSI
Kranjčević M, Riemann B, Adelmann A, Streun A
Multiobjective optimization of the dynamic aperture using surrogate models based on artificial neural networks
Physical Review Accelerators and Beams. 2021; 24(1): 014601 (15 pp.). https://doi.org/10.1103/PhysRevAccelBeams.24.014601
DORA PSI
Krepel J, Raffuzzi V
Mapping of sodium void effect and Doppler constant in ESFR-smart core with Monte Carlo code serpent and deterministic code ERANOS
In: Margulis M, Blaise P, eds. PHYSOR2020 - international conference on physics of reactors: transition to a scalable nuclear future. Vol. 247. EPJ web of conferences. Les Ulis Cedex A: EDP Sciences; 2021:13004 (8 pp.). https://doi.org/10.1051/epjconf/202124713004
DORA PSI
Lenggenhager PM, Liu X, Tsirkin SS, Neupert T, Bzdušek T
From triple-point materials to multiband nodal links
Physical Review B. 2021; 103(12): L121101 (6 pp.). https://doi.org/10.1103/PhysRevB.103.L121101
DORA PSI
Li S, Zacharias M, Snuverink J, Coello de Portugal J, Perez-Cruz F, Reggiani D, et al.
A novel approach for classification and forecasting of time series in particle accelerators
Information. 2021; 12(3): 121 (21 pp.). https://doi.org/10.3390/info12030121
DORA PSI
Mantzaras J, Sui R, Law CK, Bombach R
Heterogeneous and homogeneous combustion of fuel-lean C₃H₈/O₂/N₂ mixtures over rhodium at pressures up to 6 bar
Proceedings of the Combustion Institute. 2021; 38(4): 6473-6482. https://doi.org/10.1016/j.proci.2020.06.029
DORA PSI
Maxim F, Karalis K, Boillat P, Banuti DT, Marquez Damian JI, Niceno B, et al.
Thermodynamics and dynamics of supercritical water pseudo-boiling
Advanced Science. 2021; 8(3): 2002312 (10 pp.). https://doi.org/10.1002/advs.202002312
DORA PSI
Muralikrishnan S, Cerfon AJ, Frey M, Ricketson LF, Adelmann A
Sparse grid-based adaptive noise reduction strategy for particle-in-cell schemes
Journal of Computational Physics: X. 2021; 11: 100094 (31 pp.). https://doi.org/10.1016/j.jcpx.2021.100094
DORA PSI
Nelson A, Neupert T, Bzdušek T, Alexandradinata A
Multicellularity of delicate topological insulators
Physical Review Letters. 2021; 126(21): 216404 (7 pp.). https://doi.org/10.1103/PhysRevLett.126.216404
DORA PSI
Nichenko S, Kalilainen J, Fernandez Moguel L, Lind T
Modelling of fission products release in VERDON-1 experiment with cGEMS: coupling of severe accident code MELCOR with GEMS thermodynamic modelling package
Annals of Nuclear Energy. 2021; 152: 107972 (11 pp.). https://doi.org/10.1016/j.anucene.2020.107972
DORA PSI
Nikitin E, Fridman E, Mikityuk K, Radman S, Fiorina C
Neutronic modelling of the FFTF control rod worth measurements with diffusion codes
In: Margulis M, Blaise P, eds. PHYSOR2020 - international conference on physics of reactors: transition to a scalable nuclear future. Vol. 247. EPJ web of conferences. Les Ulis Cedex A: EDP Sciences; 2021:10017 (8 pp.). https://doi.org/10.1051/epjconf/202124710017
DORA PSI
Patt J, Alenfelder J, Pfeil EM, Voss JH, Merten N, Eryilmaz F, et al.
An experimental strategy to probe Gq contribution to signal transduction in living cells
Journal of Biological Chemistry. 2021; 296: 100472 (17 pp.). https://doi.org/10.1016/j.jbc.2021.100472
DORA PSI
Pelloni S, Rochman D
Addressing challenges in nuclear data adjustment techniques using integral experiments based upon uranium solution thermal systems
Annals of Nuclear Energy. 2021; 163: 108590 (12 pp.). https://doi.org/10.1016/j.anucene.2021.108590
DORA PSI
Petrović Đ, Mikityuk K
Machine learning-based methodology for assessment of Doppler reactivity of sodium-cooled fast reactor
Journal of Nuclear Engineering and Radiation Science. 2021; 7(4): 042004 (6 pp.). https://doi.org/10.1115/1.4050216
DORA PSI
Raffuzzi V, Krepel J
Simulation of breed and burn fuel cycle operation of molten salt reactor in batch-wise refueling mode
In: Margulis M, Blaise P, eds. PHYSOR2020 - international conference on physics of reactors: transition to a scalable nuclear future. Vol. 247. EPJ web of conferences. Les Ulis Cedex A: EDP Sciences; 2021:13003 (8 pp.). https://doi.org/10.1051/epjconf/202124713003
DORA PSI
Rizzardi Q, Derlet PM, Maaß R
Microstructural signatures of dislocation avalanches in a high-entropy alloy
Physical Review Materials. 2021; 5(4): 043604 (10 pp.). https://doi.org/10.1103/PhysRevMaterials.5.043604
DORA PSI
Ryzhkov MV, Enyashin AN, Delley B
First-principles study on the plutonium ions interaction with diamide molecules in acid solutions
International Journal of Quantum Chemistry. 2021; 121(16): e26681 (16 pp.). https://doi.org/10.1002/qua.26681
DORA PSI
Ryzhkov MV, Enyashin AN, Delley B
Plutonium complexes in water: new approach to ab initio modeling
Radiochimica Acta. 2021; 109(5): 327-342. https://doi.org/10.1515/ract-2020-0091
DORA PSI
Sui R, Mantzaras J, Law CK, Bombach R, Khatoonabadi M
Homogeneous ignition of H₂/CO/O₂/N₂ mixtures over palladium at pressures up to 8 bar
Proceedings of the Combustion Institute. 2021; 38(4): 6583-6591. https://doi.org/10.1016/j.proci.2020.06.262
DORA PSI
Ukleev V, Karube K, Derlet PM, Wang CN, Luetkens H, Morikawa D, et al.
Frustration-driven magnetic fluctuations as the origin of the low-temperature skyrmion phase in Co₇Zn₇Mn₆
npj Quantum Materials. 2021; 6(1): 40 (8 pp.). https://doi.org/10.1038/s41535-021-00342-5
DORA PSI
Verdel R, Schmitt M, Huang Y-P, Karpov P, Heyl M
Variational classical networks for dynamics in interacting quantum matter
Physical Review B. 2021; 103(16): 165103 (17 pp.). https://doi.org/10.1103/PhysRevB.103.165103
DORA PSI
Wang S, Mikityuk K, Dorde P, Zhang D, Su G, Qiu S, et al.
Validation of TRACE capability to simulate unprotected transients in Sodium Fast Reactor using FFTF LOFWST Test #13
Annals of Nuclear Energy. 2021; 164: 108600 (15 pp.). https://doi.org/10.1016/j.anucene.2021.108600
DORA PSI
Xu Y, Das L, Ma JZ, Yi CJ, Nie SM, Shi YG, et al.
Unconventional transverse transport above and below the magnetic transition temperature in Weyl semimetal EuCd₂As₂
Physical Review Letters. 2021; 126(7): 076602 (7 pp.). https://doi.org/10.1103/PhysRevLett.126.076602
DORA PSI
de Groot FMF, Elnaggar H, Frati F, Wang R-pan, Delgado-Jaime MU, van Veenendaal M, et al.
2p x-ray absorption spectroscopy of 3d transition metal systems
Journal of Electron Spectroscopy and Related Phenomena. 2021; 249: 147061 (23 pp.). https://doi.org/10.1016/j.elspec.2021.147061
DORA PSI
de Oliveira RGG, Hombourger BA
Fuel tap: a simplified breed and burn MSR
In: Margulis M, Blaise P, eds. PHYSOR2020 - international conference on physics of reactors: transition to a scalable nuclear future. Vol. 247. EPJ web of conferences. Les Ulis Cedex A: EDP Sciences; 2021:01007 (8 pp.). https://doi.org/10.1051/epjconf/202124701007
DORA PSI
Albà A, Adelmann A, Fallahi A
OPAL-MITHRA: self-consistent software for start-to-end simulation of undulator-based facilities
In: 33rd international vacuum nanoelectronics conference (IVNC) July 6-7, 2020. 2020 33rd international vacuum nanoelectronics conference (IVNC). Piscataway, New Jersey, United States: Institute of Electrical and Electronics Engineers; 2020:9203404 (2 pp.). https://doi.org/10.1109/IVNC49440.2020.9203404
DORA PSI
Andreani M, Kapulla R, Kelm S, Paladino D, Paranjape S
Analyses of gas stratification erosion by a vertical jet in presence of an obstacle using the GOTHIC code
Journal of Nuclear Engineering and Radiation Science. 2020; 6(2): 021110 (18 pp.). https://doi.org/10.1115/1.4046296
DORA PSI
Andreani M, Paranjape S
Gas mixing caused by interacting heat sources. Part ii: modelling
Nuclear Engineering and Design. 2020; 370: 110887 (16 pp.). https://doi.org/10.1016/j.nucengdes.2020.110887
DORA PSI
Bocharov D, Krack M, Rafalskij Y, Kuzmin A, Purans J
Ab initio molecular dynamics simulations of negative thermal expansion in ScF₃: the effect of the supercell size
Computational Materials Science. 2020; 171: 109198 (7 pp.). https://doi.org/10.1016/j.commatsci.2019.109198
DORA PSI
Bocharov D, Anspoks A, Timoshenko J, Kalinko A, Krack M, Kuzmin A
Interpretation of the Cu K-edge EXAFS spectra of Cu₃N using ab initio molecular dynamics
Radiation Physics and Chemistry. 2020; 175: 108100 (4 pp.). https://doi.org/10.1016/j.radphyschem.2018.12.020
DORA PSI
Bouhon A, Bzdušek T, Slager R-J
Geometric approach to fragile topology beyond symmetry indicators
Physical Review B. 2020; 102(11): 115135 (29 pp.). https://doi.org/10.1103/PhysRevB.102.115135
DORA PSI
Bouhon A, Wu QS, Slager R-J, Weng H, Yazyev OV, Bzdušek T
Non-Abelian reciprocal braiding of Weyl points and its manifestation in ZrTe
Nature Physics. 2020; 16: 1137-1143. https://doi.org/10.1038/s41567-020-0967-9
DORA PSI
Bureš L, Sato Y
Direct numerical simulation of phase change in the presence of non-condensable gases
International Journal of Heat and Mass Transfer. 2020; 151: 119400 (18 pp.). https://doi.org/10.1016/j.ijheatmasstransfer.2020.119400
DORA PSI
Bureš L, Sato Y
Sharp-interface phase-change model with the VOF method
In: 5th thermal and fluids engineering conference (TFEC). Vol. 2020-April. Proceedings of the thermal and fluids engineering summer conference. New York, NY, USA: Begell House Inc.; 2020:63-66. https://doi.org/10.1615/TFEC2020.cmd.031939
DORA PSI
Calvo P, Oliver C, Adelmann A, Frey M, Gsell A, Snuverink J
Beam stripping interactions implemented in cyclotrons with opal simulation code
In: Conradie L, Garrett De Villiers J, Schaa VRW, eds. CYC2019. 22nd international conference on cyclotrons and their applications. Vol. 22. International conference on cyclotrons and their applications. Geneva: JACoW Publishing; 2020:109-112. https://doi.org/10.18429/JACoW-Cyclotrons2019-MOP034
DORA PSI
Dehbi A
Correcting for tube curvature effects on condensation in the presence of a noncondensable gas in laminar regimes
International Journal of Heat and Mass Transfer. 2020; 151: 119384 (9 pp.). https://doi.org/10.1016/j.ijheatmasstransfer.2020.119384
DORA PSI
Derlet PM
Correlated disorder in a model binary glass through a local SU(2) bonding topology
Physical Review Materials. 2020; 4(12): 125601 (18 pp.). https://doi.org/10.1103/PhysRevMaterials.4.125601
DORA PSI
Derlet PM, Maaß R
Emergent structural length scales in a model binary glass - the micro-second molecular dynamics time-scale regime
Journal of Alloys and Compounds. 2020; 821: 153209 (11 pp.). https://doi.org/10.1016/j.jallcom.2019.153209
DORA PSI
Derlet PM, Dudarev SL
Microscopic structure of a heavily irradiated material
Physical Review Materials. 2020; 4(2): 023605 (20 pp.). https://doi.org/10.1103/PhysRevMaterials.4.023605
DORA PSI
Dobitz S, Wilhelm P, Romantini N, De Foresta M, Walther C, Ritler A, et al.
Distance-dependent cellular uptake of oligoproline-based homobivalent ligands targeting GPCRs - an experimental and computational analysis
Bioconjugate Chemistry. 2020; 31(10): 2431-2438. https://doi.org/10.1021/acs.bioconjchem.0c00484
DORA PSI
Edelen A, Neveu N, Frey M, Huber Y, Mayes C, Adelmann A
Machine learning for orders of magnitude speedup in multiobjective optimization of particle accelerator systems
Physical Review Accelerators and Beams. 2020; 23(4): 044601 (23 pp.). https://doi.org/10.1103/PhysRevAccelBeams.23.044601
DORA PSI
Frey M, Adelmann A
Global sensitivity analysis on numerical solver parameters of particle-in-cell models in particle accelerator systems
Computer Physics Communications. 2020; 258: 107577 (17 pp.). https://doi.org/10.1016/j.cpc.2020.107577
DORA PSI
Frey M, Adelmann A, Locans U
On architecture and performance of adaptive mesh refinement in an electrostatics Particle-In-Cell code
Computer Physics Communications. 2020; 247: 106912 (18 pp.). https://doi.org/10.1016/j.cpc.2019.106912
DORA PSI
García-Recio A, Navarro G, Franco R, Olivella M, Guixà-González R, Cordomí A
DIMERBOW: exploring possible GPCR dimer interfaces
Bioinformatics. 2020; 36(10): 3271-3272. https://doi.org/10.1093/bioinformatics/btaa117
DORA PSI
Grob NM, Häussinger D, Deupi X, Schibli R, Behe M, Mindt TL
Triazolo-peptidomimetics: novel radiolabeled minigastrin analogs for improved tumor targeting
Journal of Medicinal Chemistry. 2020; 63(9): 4484-4495. https://doi.org/10.1021/acs.jmedchem.9b01936
DORA PSI
Guguchia Z, Das D, Wang CN, Adachi T, Kitajima N, Elender M, et al.
Using uniaxial stress to probe the relationship between competing superconducting states in a cuprate with spin-stripe order
Physical Review Letters. 2020; 125(9): 097005 (7 pp.). https://doi.org/10.1103/PhysRevLett.125.097005
DORA PSI
Guo W, Shams A, Sato Y, Niceno B
Influence of buoyancy in a mixed convection liquid metal flow for a horizontal channel configuration
International Journal of Heat and Fluid Flow. 2020; 85: 108630 (13 pp.). https://doi.org/10.1016/j.ijheatfluidflow.2020.108630
DORA PSI
Halouane Y, Dehbi A
CFD prediction of hydrogen passive autocatalytic recombiner performance under counter-current flow conditions
International Journal of Hydrogen Energy. 2020; 45(16): 10247-10256. https://doi.org/10.1016/j.ijhydene.2020.01.189
DORA PSI
Hofhuis K, Hrabec A, Arava H, Leo N, Huang Y-L, Chopdekar RV, et al.
Thermally superactive artificial kagome spin ice structures obtained with the interfacial Dzyaloshinskii-Moriya interaction
Physical Review B. 2020; 102(18): 180405(R) (6 pp.). https://doi.org/10.1103/PhysRevB.102.180405
DORA PSI
Hombourger B, Křepel J, Pautz A
The EQL0D fuel cycle procedure and its application to the transition to equilibrium of selected molten salt reactor designs
Annals of Nuclear Energy. 2020; 144: 107504 (18 pp.). https://doi.org/10.1016/j.anucene.2020.107504
DORA PSI
Huang S-M, Huang Y-P, Lee T-K
Slave-rotor theory on magic-angle twisted bilayer graphene
Physical Review B. 2020; 101(23): 235140 (12 pp.). https://doi.org/10.1103/PhysRevB.101.235140
DORA PSI
Hursin M, Pelloni S, Vasiliev A, Ferroukhi H
Treatment of the implicit effect in Shark-X
Annals of Nuclear Energy. 2020; 138: 107178 (14 pp.). https://doi.org/10.1016/j.anucene.2019.107178
DORA PSI
Kalilainen J, Nichenko S, Krepel J
Evaporation of materials from the molten salt reactor fuel under elevated temperatures
Journal of Nuclear Materials. 2020; 533: 152134 (13 pp.). https://doi.org/10.1016/j.jnucmat.2020.152134
DORA PSI
Kéri A, Dähn R, Marques Fernandes M, Scheinost AC, Krack M, Churakov SV
Iron adsorption on clays inferred from atomistic simulations and X-ray absorption spectroscopy
Environmental Science and Technology. 2020; 54(19): 11886-11893. https://doi.org/10.1021/acs.est.9b07962
DORA PSI
Kühne TD, Iannuzzi M, Del Ben M, Rybkin VV, Seewald P, Stein F, et al.
CP2K: an electronic structure and molecular dynamics software package - quickstep: efficient and accurate electronic structure calculations
Journal of Chemical Physics. 2020; 152(19): 194103 (47 pp.). https://doi.org/10.1063/5.0007045
DORA PSI
Lapierre B, Choo K, Tauber C, Tiwari A, Neupert T, Chitra R
Emergent black hole dynamics in critical Floquet systems
Physical Review Research. 2020; 2(2): 023085 (11 pp.). https://doi.org/10.1103/PhysRevResearch.2.023085
DORA PSI
Lapierre B, Choo K, Tiwari A, Tauber C, Neupert T, Chitra R
Fine structure of heating in a quasiperiodically driven critical quantum system
Physical Review Research. 2020; 2(3): 033461 (13 pp.). https://doi.org/10.1103/PhysRevResearch.2.033461
DORA PSI
Lehmann J, Bortis A, Derlet PM, Donnelly C, Leo N, Heyderman LJ, et al.
Relation between microscopic interactions and macroscopic properties in ferroics
Nature Nanotechnology. 2020; 15: 896-900. https://doi.org/10.1038/s41565-020-0763-9
DORA PSI
Li X, Prasser H-M, Niceno B
URANS simulations of the single-phase mixing in a 4*4 LWR fuel bundle with mixing vanes, validated against a sub-channel experiment
Nuclear Engineering and Design. 2020; 363: 110612 (13 pp.). https://doi.org/10.1016/j.nucengdes.2020.110612
DORA PSI
Maceira IA, Mila F, Müller M
Perturbative approach to tunneling and quantum interferences in spin clusters
Physical Review B. 2020; 101(10): 104416 (17 pp.). https://doi.org/10.1103/PhysRevB.101.104416
DORA PSI
Mason DR, Das S, Derlet PM, Dudarev SL, London AJ, Yu H, et al.
Observation of transient and asymptotic driven structural states of tungsten exposed to radiation
Physical Review Letters. 2020; 125(22): 225503 (7 pp.). https://doi.org/10.1103/PhysRevLett.125.225503
DORA PSI
Mayol E, García-Recio A, Tiemann JKS, Hildebrand PW, Guixà-González R, Olivella M, et al.
HomolWat: a web server tool to incorporate 'homologous' water molecules into GPCR structures
Nucleic Acids Research. 2020; 48(W1): W54-W59. https://doi.org/10.1093/nar/gkaa440
DORA PSI
Mikityuk K, Ammirabile L, Forni M, Jagielski J, Girault N, Horvath A, et al.
Review of Euratom projects on design, safety assessment, R&D and licensing for ESNII/Gen-IV fast neutron systems
EPJ Nuclear Sciences and Technologies. 2020; 6: 36 (17 pp.). https://doi.org/10.1051/epjn/2019007
DORA PSI
Müller M, Derlet PM, Mudry C, Aeppli G
Testing of asymptomatic individuals for fast feedback-control of COVID-19 pandemic
Physical Biology. 2020; 17(6): 065007 (20 pp.). https://doi.org/10.1088/1478-3975/aba6d0
DORA PSI
Nick N, Sato Y
Computational fluid dynamics simulation of Hyperloop pod predicting laminar–turbulent transition
Railway Engineering Science. 2020; 28(1): 97-111. https://doi.org/10.1007/s40534-020-00204-z
DORA PSI
Padhi B, Tiwari A, Neupert T, Ryu S
Transport across twist angle domains in moiré graphene
Physical Review Research. 2020; 2(3): 033458 (16 pp.). https://doi.org/10.1103/PhysRevResearch.2.033458
DORA PSI
Pelloni S, Rochman D
Resonance parameter adjustment in the resolved region based upon an Asymptotic Generalized Linear Least-Squares methodology in conjunction with the Monte Carlo method
Annals of Nuclear Energy. 2020; 145: 107509 (9 pp.). https://doi.org/10.1016/j.anucene.2020.107509
DORA PSI
Plompen AJM, Cabellos O, De Saint Jean C, Fleming M, Algora A, Angelone M, et al.
The joint evaluated fission and fusion nuclear data library, JEFF-3.3
European Physical Journal A: Hadrons and Nuclei. 2020; 56(7): 181 (108 pp.). https://doi.org/10.1140/epja/s10050-020-00141-9
DORA PSI
Rizzoglio V, Adelmann A, Gerbershagen A, Meer D, Nesteruk KP, Schippers JM
Uncertainty quantification analysis and optimization for proton therapy beam lines
Physica Medica. 2020; 75: 11-18. https://doi.org/10.1016/j.ejmp.2020.05.013
DORA PSI
Rodríguez-Espigares I, Torrens-Fontanals M, Tiemann JKS, Aranda-García D, Ramírez-Anguita JM, Stepniewski TM, et al.
GPCRmd uncovers the dynamics of the 3D-GPCRome
Nature Methods. 2020; 17: 777-787. https://doi.org/10.1038/s41592-020-0884-y
DORA PSI
Savchenko TM, Buzzi M, Howald L, Ruta S, Vijayakumar J, Timm M, et al.
Single femtosecond laser pulse excitation of individual cobalt nanoparticles
Physical Review B. 2020; 102(20): 205418 (12 pp.). https://doi.org/10.1103/PhysRevB.102.205418
DORA PSI
Saxena A, Prasser H-M
A study of two-phase annular flow using unsteady numerical computations
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Maximizing property tuning of phosphorus corrole photocatalysts through a trifluoromethylation approach
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Zhu M, Dehbi A, Sato Y, Niceno B
Simulations of particle transport inside bubbles using coupled interface and Lagrangian tracking approaches
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Adelmann A, Rogers C, Sheehy SL
Fixed Field Accelerators and space charge modeling
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Real-time tomography of gas-jets with a Wollaston Interferometer
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Aksouh M, Dehbi A
Large Eddy simulations of particulate flows inside a square differentially heated cavity at Rayleigh numbers up to 10¹¹
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Andreani M, Kapulla R
Analyses of gas stratification erosion by a vertical jet in presence of an obstacle using the GOTHIC code
In: Proceedings of the 26th international conference on nuclear engineering (ICONE26). Thermal hydraulics and safety analyses. Vol. 6B. New York: American Society of Mechanical Engineers (ASME); 2018:ICONE26-82360 (11 pp.). https://doi.org/10.1115/ICONE26-82360
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Andreani M, Paladino D, Papini D
Multi-step planning calculations with the GOTHIC code used for the design of complex experiments in the PANDA facility
Nuclear Engineering and Design. 2018; 339: 116-125. https://doi.org/10.1016/j.nucengdes.2018.09.005
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Arani BO, Frouzakis CE, Mantzaras J, Lucci F, Boulouchos K
Direct numerical simulation of turbulent channel-flow catalytic combustion: effects of Reynolds number and catalytic reactivity
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Arani BO, Mantzaras J, Frouzakis CE, Boulouchos K
Hetero-/homogeneous chemistry interactions and flame formation during methane catalytic partial oxidation in rhodium-coated channels
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Computational logic with square rings of nanomagnets
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Badreddine H, Lafferty N, Ničeno B, Prasser H-M
Corrective interface tracking approach to simulate finite-size bubbly flows
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Badreddine H, Ničeno B
Simulations of droplet merging with free surface and bubble column reactor with finite-size Lagrangian particle tracking
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Element specific determination of the magnetic properties of two macrocyclic tetranuclear 3d-4f complexes with a Cu₃Tb core by means of X-ray magnetic circular dichroism (XMCD)
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Magnetic properties of single rare-earth atoms on graphene/Ir(111)
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Becquart CS, Ngayam Happy R, Olsson P, Domain C
A DFT study of the stability of SIAs and small SIA clusters in the vicinity of solute atoms in Fe
Journal of Nuclear Materials. 2018; 500: 92-109. https://doi.org/10.1016/j.jnucmat.2017.12.022
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Bodi J, Mikityuk K, Ponomarev A, Guidez J
Use of CAD models in ESFR-SMART EU project
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Unsteady single-phase natural-circulation flow mixing prediction using 3-D thermal-hydraulic system and CFD Codes
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Clifford I, Pecchia M, Puragliesi R, Vasiliev A, Ferroukhi H
On the characteristics of the flow and heat transfer in the core bypass region of a PWR
Nuclear Engineering and Design. 2018; 330: 117-128. https://doi.org/10.1016/j.nucengdes.2018.01.039
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Derlet PM, Maaß R
Local volume as a robust structural measure and its connection to icosahedral content in a model binary amorphous system
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Derlet PM, Maaß R
Thermally-activated stress relaxation in a model amorphous solid and the formation of a system-spanning shear event
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Di Filippo M, Krepel J, Mikityuk K, Prasser H-M
Analysis of major group structures used for nuclear reactor simulations
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Fiorina C, Pautz A, Mikityuk K
Creation of an OpenFOAM fuel performance class based on FRED and integration into the GeN-Foam multi-physics code
In: Proceedings of the 26th international conference on nuclear engineering (ICONE26). Nuclear fuel and material, reactor physics, and transport theory. New York: American Society of Mechanical Engineers (ASME); 2018:ICONE26-81574 (7 pp.). https://doi.org/10.1115/ICONE26-81574
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Convergent evolution of tertiary structure in rhodopsin visual proteins from vertebrates and box jellyfish
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