Selected Peer-Reviewed Publications
(Recent publications list also -
more or less regularly
- updated at
Google Scholar)
I. Baldea, Y. Chen, M. Zhang, N. Xin, Y. Feng, J. Feng, C. Jia, X. Guo, Z. Xie
Breakdown of Ohm's Law in Molecular Junctions with Electrodes of Single-Layer Graphene
J. Phys. Chem. Lett.
15
(2024) 3267
I. Baldea
Dichotomy between Level Broadening and Level Coupling to Electrodes in Large Area EGaIn Molecular Junctions
J. Phys. Chem. Lett.
15
(2024) 2916
(preprint chemRxiv here)
I. Baldea
Gaining insight into molecular tunnel junctions with a pocket calculator without I-V data fitting. Five-thirds protocol
Phys. Chem. Chem. Phys.
26
(2024) 8724
(Open access)
(preprint arXiv here)
I. Baldea
Comment on "A single level tunneling model for molecular junctions: evaluating the simulation methods" by Opodi et al
Phys. Chem. Chem. Phys.
26
(2024) 7230
(Open access)
(preprint chemRxiv here)
Y. Chen,
I. Baldea
, Y. Yu, Z. Liang, M.-D. Li, E. Koren and Z. Xie
CP-AFM Molecular Tunnel Junctions with Alkyl Backbones Anchored Using Alkynyl and Thiol Groups: Microscopically Different Despite Phenomenological Similarity
Langmuir
40
(2024) 4410
(Open access)
I. Baldea
Can tunneling current in molecular junctions be so strongly temperature dependent to challenge a hopping mechanism? Analytical formulas answer this question and provide important insight into large area junctions
Phys. Chem. Chem. Phys.
26
(2024) 6540
(Open access)
(preprint chemRxiv here)
I. Baldea
Antioxidant Activity via Free Radical Scavenging of Pitavastatin and Its Hydroxylated Derivatives: A Quantum Chemical Attempt Aiming to Assist Drug Development
Adv. Theory Simul.
7
(2024) 2301123
(preprint chemRxiv here)
I. Baldea
Can room temperature data for tunneling molecular junctions be analyzed within a theoretical framework assuming zero temperature?
Phys. Chem. Chem. Phys.
25
(2023) 19750
(preprint chemRxiv here)
I. Baldea
Estimating the Number of Molecules in Molecular Junctions Merely Based on the Low Bias Tunneling Conductance at Variable Temperature
Int. J. Mol. Sci.
23
(2022) 14985
(Open access)
I. Baldea
Two Theorems and Important Insight on How the Preferred Mechanism of Free Radical Scavenging Cannot Be Settled. Comment on Pandithavidana, D.R.; Jayawardana, S.B. Comparative Study of Antioxidant Potential of Selected Dietary Vitamins; Computational Insights. Molecules 2019, 24, 1646
Molecules
27
(2022) 8092
(Open access )
I. Baldea
Chemical bonding in representative astrophysically relevant neutral, cation, and anion HCnH chains
Chin. Phys. B
31
123101 (2022) DOI 10.1088/1674-1056/ac9b04
Invited paper for the Third Carbon Special Topic
(preprint chemRxiv here)
I. Baldea
Critical analysis of radical scavenging properties of atorvastatin in methanol recently estimated via density functional theory
Comp. Theor. Chem.
1217
(2022) 113898
(viewpoint article)
(preprint chemRxiv here)
I. Baldea
Why Ortho- and Para-Hydroxy Metabolites Can Scavenge Free Radicals That the Parent Atorvastatin Cannot? Important Pharmacologic Insight from Quantum Chemistry
Molecules
27
(2022) 5036
(Open access )
Invited paper to the Commemorative Special Issue Honoring Professor Donald Truhlar
I. Baldea
Comprehensive Quantum Chemical Characterization of the Astrochemically Relevant HC
n
H Chain Family. An Attempt to Aid Astronomical Observations
Adv. Theory Simul.
5
(2022) 202200244
(Open access )
I. Baldea
HC
n
H
-
Anion Chains with n \leq 8 are Nonlinear and Their Permanent Dipole Makes Them Potential Candidates for Astronomical Observation
Molecules
27
(2022) 3100
(Open access )
Invited paper to the Commemorative Special Issue Honoring Professor Donald Truhlar
I. Baldea
Exact Analytic Formula for Conductance Predicting a Tunable Sommerfeld-Arrhenius Thermal Transition within a Single-Step Tunneling Mechanism in Molecular Junctions Subject to Mechanical Stretching
Adv. Theory Simul.
5
(2022) 202200158
(Open access )
I. Baldea
Are Asymmetric SAM-Induced Work Function Modifications Relevant for Real Molecular Rectifiers?
Adv. Theory Simul.
5
(2022) 202200077
(Open access )
I. Baldea
Alternation of Singlet and Triplet States in Carbon-Based Chain Molecules and Its Astrochemical Implications. Results of an Extensive Theoretical Study
Adv. Theory Simul.
5
(2022) 2100480
Z. Xie,
I. Baldea
, Q. Nguyen and C. D. Frisbie
Quantitative Analysis of Weak Current Rectification in Molecular Tunnel Junctions Subject to Mechanical Deformation Reveals Two Different Rectification Mechanisms for Oligophenylene Thiols versus Alkane Thiols
Nanoscale
13
(39), 16755 (2021)
I. Baldea
Why asymmetric molecular coupling to electrodes cannot be at work in real molecular rectifiers
Phys. Rev. B
103
(19), 195408 (2021)
I. Baldea
What Can We Learn from the Time Evolution of COVID-19 Epidemic in Slovenia?
Advanced Theory and Simulations
4
(7), 2000225 (2021)
(Open access)
(most downloaded during its 12 months of publication in an issue between 1 Jan - 31 Dec 2021)
I. Baldea
Self-assembled monolayers of oligophenylenes stiffer than steel and silicon, possibly even stiffer than Si
3
N
4
Appl. Surf. Sci. Adv.
5C
100094 (2021)
(Open access)
I. Baldea
Correction to Extensive Quantum Chemistry Study of Neutral and Charged C
4
N Chains: An Attempt to Aid Astronomical Observations
ACS Earth Space Chem.
5
(12), 3523 (2021)
I. Baldea
Suppression of Groups Intermingling as Appealing Option For Flattening and Delaying the Epidemiologic Curve While Allowing Economic and Social Life at Bearable Level During COVID-19 Pandemic
Advanced Theory and Simulations
3
(2020) 2000132
(Open access)
I. Baldea
Profiling Astrophysically Relevant MgC
4
H chains. An Attempt to Aid Astronomical Observations
Monthly Notices of the Royal Astronomical Society
498
(2020) 4316
I. Baldea
Profiling C
4
N Radicals of Astrophysical Interest
Monthly Notices of the Royal Astronomical Society
493
(2020) 2506
I. Baldea
Extensive Quantum Chemistry Study of Neutral and Charged C
4
N Chains: An Attempt to Aid Astronomical Observations
ACS Earth Space Chem.
4
(2020) 434
I. Baldea
Evidence that Molecules in Molecular Junctions May not Be Subject to the Entire External Perturbation Applied to Electrodes
Langmuir
36
(2020) 1329
Z. Xie,
I. Baldea
, and C. D. Frisbie
Energy Level Alignment in Molecular Tunnel Junctions by Transport and Spectroscopy: Self-Consistency for the Case of Alkyl Thiols and Dithiols on Ag, Au, and Pt Electrodes
J. Am. Chem. Soc.
141
(2019) 18182
I. Baldea
Alternation of Singlet and Triplet States in Carbon-Based Chain Molecules and Its Astrochemical Implications. Results of an Extensive Theoretical Study
Adv. Theory Simul.
2
(2019) 1900084
I. Baldea
Impact of molecular conformation on transport and transport-related properties at the nanoscale
Appl. Surf. Sci.
487
(2019) 593-600
I. Baldea
Long Carbon-Based Chains of Interstellar Medium Can Have a Triplet Ground State. Why Is This Important for Astrochemistry?
ACS Earth Space Chem.
3
(2019) 863-872
Included in the Virtual Issue
Astrochemistry: From the Chemical Laboratory to the Stars
Z. Xie,
I. Baldea
, and C. D. Frisbie
Determination of Energy Level Alignment in Molecular Tunnel Junctions by Transport and Spectroscopy: Self-Consistency for the Case of Oligophenylene Thiols and Dithiols on Ag, Au, and Pt Electrodes
J. Am. Chem. Soc.
141
(2019) 3670-3681
Z. Xie,
I. Baldea
, G. Haugstad and C. D. Frisbie
Mechanical Deformation Distinguishes Tunneling Pathways in Molecular Junctions
J. Am. Chem. Soc.
141
(2019) 497-504
I. Baldea
Specific Issues Related to the Law of Corresponding States for the Charge Transport in Molecular Junctions Based on Graphene Electrodes
Appl. Surf. Sci.
474
(2019) 256-261
I. Baldea
A novel route to get functionality in nanoelectronics: controlling the charge transport by the subtle impact of the coverage of self-assembled monolayers on the conformation of floppy molecules adsorbed on metallic electrodes
Appl. Surf. Sci.
472
(2019) 16-21
I. Baldea
A
Sui Generis
Electrode-Driven Spatial Confinement Effect Responsible for Strong Twisting Enhancement of Floppy Molecules in Closely Packed Self-Assembled Monolayers
Phys. Chem. Chem. Phys.
20
(2018) 23492-23499
Z. Xie,
I. Baldea
and C. D. Frisbie
Why One Can Expect Large Rectification in Molecular Junctions Based on Alkane Monothiols and Why Rectification Is So Modest
Chem. Sci.
9
(2018) 4456-4467
C. E. Smith, Z. Xie,
I. Baldea
and C. D. Frisbie
Work Function and Temperature Dependence of Electron Tunneling through an N-Type Perylene Diimide Molecular Junction with Isocyanide Surface Linkers
Nanoscale
10
964-975 (2018)
I. Baldea
Floppy Molecules as Candidates for Achieving Optoelectronic Molecular Devices without Skeletal Rearrangement or Bond Breaking
Phys. Chem. Chem. Phys.
19
(2017) 30842-30851
D. Amabilino,
I. Baldea
, O. Barykina et al,
Preparing macromolecular systems on surfaces: general discussion
Faraday Disc.
204
(2017) 395-418.
Publication in Faraday Discussions theme issue "Complex Molecular Surfaces and Interfaces"
(24-26 July 2017, Sheffield, UK)
D. Amabilino,
I. Baldea
, P. Besenius et al,
Supramolecular systems at liquid-solid interfaces: general discussion
Faraday Disc.
204
(2017) 271-295.
Publication in Faraday Discussions theme issue "Complex Molecular Surfaces and Interfaces"
(24-26 July 2017, Sheffield, UK)
D. Amabilino,
I. Baldea
, J. Batteas et al,
Supramolecular effects in self-assembled monolayers: general discussion
Faraday Disc.
204
(2017) 123-158.
Publication in Faraday Discussions theme issue "Complex Molecular Surfaces and Interfaces"
(24-26 July 2017, Sheffield, UK)
D. Amabilino,
I. Baldea
, J. Batteas et al,
Probing properties of molecule-based interface systems: general discussion and Discussion of the Concluding Remarks
Faraday Disc.
204
(2017) 503-530.
Publication in Faraday Discussions theme issue "Complex Molecular Surfaces and Interfaces"
(24-26 July 2017, Sheffield, UK)
I. Baldea
Important Issues Related to the Law of Corresponding States for the Charge Transport in Molecular Junctions with Graphene Electrodes
Org. Electron.
49
(2017) 19-23
I. Baldea
A surprising way to control the charge transport in molecular electronics: the subtle impact of the coverage of SAM of floppy molecules adsorbed on electrodes
Faraday Disc.
204
(2017) 35-52.
Publication in Faraday Discussions theme issue "Complex Molecular Surfaces and Interfaces"
(24-26 July 2017, Sheffield, UK)
Z. Xie,
I. Baldea
, A. Demissie, C. Smith, Y. Wu, G. Haugstad, and C. D. Frisbie
Exceptionally Small Statistical Variations in the Transport Properties of Metal-Molecule-Metal Junctions Composed of 80 Oligophenylene Dithiol Molecules
J. Am. Chem. Soc. (Communication)
139
(2017) 5696
(freely available via an ACS ID, which is free and available to everyone)
I. Baldea
Protocol for Disentangling the Thermally Activated Contribution to the Tunneling-Assisted Charge Transport. Analytical Results and Experimental Relevance
Phys. Chem. Chem. Phys.
19
11759-11770 (2017)
(highlighted on the PCCP cover)
I. Baldea
Vibrational Frequencies of Fractionally Charged Molecular Species: Benchmarking DFT Results against Ab Initio Calculations
J. Phys. Chem. A
121
(2017) 2282
(freely available via an ACS ID, which is free and available to everyone)
I. Baldea
Vibrational Properties of Fractionally Charged Molecules and Their Relevance for Molecular Electronics and Electrochemistry
Chem. Phys.
482
(2017) 311
Z. Xie,
I. Baldea
, S. Oram, C. Smith, and C. D. Frisbie
Effect of Heteroatom Substitution on Transport in Alkanedithiol-Based Molecular Tunnel Junctions: Evidence for Universal Behavior
ACS Nano
11
(2017) 569
(freely available via an ACS ID, which is free and available to everyone)
I. Baldea
Scaling properties and related issues in the charge transport through molecular junctions
Materials Today: Proceedings
4
(2017) 11519
I. Baldea
Tuning the conformation of floppy molecules by charge transfer
RSC Adv. (Communication)
6
(2016) 111903
(Open access)
I. Baldea
Fractional molecular charge studied via molecular vibrational properties. Specific aspects in Jahn-Teller active molecular species
RSC Adv.
6
(2016) 92715
(Open access)
I. Baldea
Important impact of the experimental platform on the efficient control of electronic and vibrational properties of molecular junctions
Int. J. Nanotechnol.
13
no 8/9, (2016) 685
I. Baldea
Invariance of molecular charge transport upon changes of extended molecule size and several related issues
Beilstein Journal of Nanotechnology
7
(2016) 418
(Open Access)
I. Baldea
Counterintuitive issues in the charge transport through molecular junctions
Phys. Chem. Chem. Phys.
17
(2015) 31260
(Open Access)
I. Baldea
Transition Voltage Spectroscopy: An Appealing Tool of Investigation in Molecular Electronics
in
Molecular Electronics: An Experimental and Theoretical Approach
(edited by I. Baldea)
Pan Stanford
(2015)
I. Baldea
(Editor)
Molecular Electronics: An Experimental and Theoretical Approach
Pan Stanford
(2015)
Z. Xie,
I. Baldea
, C. Smith, Y. Wu, and C. D. Frisbie
Experimental and Theoretical Analysis of Nanotransport in Oligophenylene Dithiol Junctions as a Function of Molecular Length and Contact Work Function
ACS Nano
9
(2015) 8022
(freely available via an ACS ID, which is free and available to everyone)
I. Baldea
Important issues facing model-based approaches to tunneling transport in molecular junctions
Phys. Chem. Chem. Phys.
17
(2015) 20217
(Open Access)
I. Baldea, Z. Xie and C. D. Frisbie
Uncovering a law of corresponding states for electron tunneling in molecular junctions
Nanoscale
7
(2015) 10465
(Open Access)
I. Baldea
Important impact of the molecule-electrode couplings asymmetry on the efficiency of bias-driven redox processes in molecular junctions
Phys. Chem. Chem. Phys.
17
(2015) 15756
(Open Access)
J. Hodgkiss, G. Conboy, G. Hutchings, S. Higgins, I. Galbraith, N. Findlay, R. Taylor, M. Salle, S. Zhang, G. Frey,
I. Baldea
, I. Samuel, B. Ebenhoch, F. Wudl, A. Turak, B. Xu, E. Angioni, R. Venkatramani, U. Lemmer, D. Perepichka, A. Kanibolotsky, P. Skabara, J. Wildman, E. Zysman-Colman, D. Bradley, I. McCulloch, J. McDouall, S. Ponomarenko, J. Nelson, J.-S. Kim
Organic photovoltaics and energy: general discussion
Faraday Discuss.
174
(2014) 341
J. Hodgkiss, E. Zysman-Colman, S. Higgins, G. Solomon,
I. Baldea
, I. Samuel, L. Venkataraman, F. Wudl, B. Xu, R. Venkatramani, H. Ottosson, D. Perepichka, U. Lemmer, P. Skabara, A. Mount, D. Bradley
Molecular electronics: general discussion
Faraday Discuss.
174
(2014) 125
I. Baldea
Electrochemical setup - a unique chance to simultaneously control orbital energies and vibrational properties of single-molecule junctions with unprecedented efficiency
Phys. Chem. Chem. Phys.
16
(2014) 25942
I. Baldea
Quantifying the relative molecular orbital alignment for molecular junctions with similar chemical linkage to electrodes
Nanotechnology
25
(2014) 455202
I. Baldea
Concurrent conductance and transition voltage spectroscopy study of scanning tunneling microscopy vacuum junctions. Does it unravel new physics?
RSC Adv.
4
(2014) 33257
I. Baldea
A quantum chemical study from a molecular transport perspective: ionization and electron attachment energies for species often used to fabricate single-molecule junctions
Faraday Discuss.
174
(2014) 35
I. Baldea and H. Koeppel
From Quantum-Dot Nanorings to Polyacetylene via Small Annulenes. A Full Configuration Interaction Description Based on an Extended Hubbard--Su-Schrieffer-Heeger Model
J. Nanomater. Mol. Nanotechnol.
3
(2014) 1
I. Baldea
Single-Molecule Junctions Based on Bipyridine: Impact of an Unusual Reorganization on the Charge Transport
J. Phys. Chem. C
118
(2014) 8676
(freely available via an ACS ID, which is free and available to everyone)
I. Baldea
Important Insight into Electron Transfer in Single−Molecule Junctions Based on Redox Metalloproteins from Transition Voltage Spectroscopy
J. Phys. Chem. C
117
(2013) 25798
(freely available via an ACS ID, which is free and available to everyone)
I. Baldea
Demonstrating why DFT−calculations for molecular transport in solvents need scissor corrections
Electrochem. Commun.
36
(2013) 19
I. Baldea
Transition voltage spectroscopy reveals significant solvent effects on molecular transport and settles an important issue in bipyridine−based junctions
Nanoscale
5
(2013) 9222.
Featured by
Reginnovations.
I Baldea, H Koeppel and W. Wenzel
(4, 4')−Bipyridine in vacuo and in solvents: A quantum chemical study of a prototypical floppy molecule from a molecular transport perspective
Phys. Chem. Chem. Phys.
15
(2013) 1918
I. Baldea
Extending the Newns−Anderson model to allow nanotransport studies through molecules with floppy degrees of freedom
Europhys. Lett.
99
(2012) 47002
I. Baldea
Transition voltage spectroscopy: Artefacts of the Simmons approach
J. Phys. Chem. Solids
73
(2012) 1151
I. Baldea
Interpretation of stochastic events in single−molecule measurements of conductance and transition voltage spectroscopy
J. Am. Chem. Soc.
134
(2012) 7958
(freely available via an ACS ID, which is free and available to everyone)
I. Baldea and H. Koeppel
Transition voltage spectroscopy in vacuum break junction: the standard tunneling barrier model and beyond
Phys. Stat. Solidi (b)
249
(2012) 1791
I. Baldea
Transition voltage spectroscopy in vacuum break junction: Possible role of surface states
Europhys. Lett.
98
(2012) 17010
I. Baldea and H. Koeppel
A physical limitation of the Wigner ``distribution'' function in molecular transport
Phys. Lett. A
376
(2012) 1645
I. Baldea and H. Koeppel
Evidence on single−molecule transport in electrostatically−gated molecular transistors
Phys. Lett. A
376
(2012) 1472
I. Baldea
Effects of stochastic fluctuations at molecule−electrode contacts in transition voltage spectroscopy
Chem. Phys.
400
(2012) 65
I. Baldea
Ambipolar transition voltage spectroscopy: Analytical results and experimental agreement
Phys. Rev. B
85
(2012) 035442
I. Baldea and H. Koeppel
Reply to "Comment on 'Critical analysis of a variational method used to describe molecular electron transport'"
Phys. Rev. B
84
(2011) 037305
I. Baldea
Revealing molecular orbital gating by transition voltage spectroscopy
Chem. Phys.
377
(2010) 15
I. Baldea and H. Koeppel
Reply to "Comment on `Electron transport through correlated molecules computed using the time-independent Wigner function: Two critical tests' "
Phys. Rev. B
82
(2010) 087302
I. Baldea, H. Koeppel, R. Maul and W. Wenzel
Applying the extended molecule approach to correlated electron transport: Important insight from model calculations
J. Chem. Phys.
82
(2010) 087302
I. Baldea and L. S. Cederbaum
Quantum−dot nanorings
in:
Handbook of Nanophysics (Nanotubes and Nanowires)
, ed. K. Sattler, Taylor and Francis, Boca Raton (2010)
I. Baldea, H. Koeppel and L. S. Cederbaum
Characterization of assembled quantum dots and single−electron transistors by photoemission and photoabsorption
Phys. Stat. Solidi C7
11-12
(2010) 2671
I. Baldea and Koeppel
Sources of negative differential resistance in electric nanotransport
Phys. Rev. B
,
81
(2010) 193401
I. Baldea and H. Koeppel
Single-electron transistors studied by microwave and far-infrared absorption: Theoretical results and experimental proposal
Phys. Rev. B
81
(2010) 125322
I. Baldea and H. Koeppel
Photoionization and Far Infrared Absorption of Single-Electron Transistors: Theoretical Results and Experiment Proposals
e-J. Surf. Sci. Nanotech.
8
(2010) 1-5
I. Baldea and H. Koeppel
Critical analysis of a variational method used to describe molecular electron transport
Phys. Rev. B
80
(2009) 165301
I. Baldea and H. Koeppel
Studying the single-electron transistor by photoionization
Phys. Rev. B
79
(2009) 165317 (selected for the May 4, 2009 issue of Virtual Journal of Nanoscale Science & Technology, http://www.vjnano.org)
I. Baldea, L. S. Cederbaum and J. Schirmer
Intriguing electron correlation effects in the photoionization of metallic quantum-dot nanorings
Eur. Phys. J. B
69
(2009) 251-264
I. Baldea and H. Koeppel
Critical analysis of a variational method used to describe molecular electron transport [Phys. Rev. B 80, 165301 (2009)]
Phys. Rev. B
80
(2009) 209902(E)
I. Baldea and L. S. Cederbaum
Unusual scarcity in the optical absorption of metallic quantum-dot nanorings described by the extended Hubbard model
Phys. Rev. B
77
(2008) 165339 (selected for the May 12, 2008 issue of Virtual Journal of Nanoscale Science & Technology, http://www.vjnano.org)
I. Baldea and L. S. Cederbaum
Unusual features in optical absorption and photo--ionisation of quantum--dot nano--rings
in:
Frontiers in Quantum Systems in Chemistry and Physics. Progress in Theoretical Chemistry and Physics
, eds. S. Wilson, P. J. Grout,G. Delgado-Barrio, J. Maruani and P. Piecuch (Springer Science + Business Media B. V., vol. 18 (2008), pp. 273--287, doi 10.1007/978-1-4020-8707-3, isbn = 978-1-4020-8706-6 (Print) 978-1-4020-8707-3 (Online)
I. Baldea and H. Koeppel
Electron transport through correlated molecules computed using the time-independent Wigner function: Two critical tests
Phys. Rev. B
78
(2008) 115315
E. Gindensperger, I. Baldea, J. Franz, and H. Koeppel
Multi-state vibronic interactions in the fluorobenzene radical cation: The importance of quadratic coupling terms
Chem. Phys.
338
(2007) 207-219
I. Baldea, B. Schimmelpfennig, M. Plaschke, J. Rothe, J. Schirmer, A. B. Trofimov, and Th. Fanghänel
C 1s near edge X-ray absorption fine structure (NEXAFS) of substituted benzoic acids--A theoretical and experimental study
J. Electron Spectr. Rel. Phen.
154
(2007) 109-118
I. Baldea, J. Franz and H. Koeppel
Jahn-Teller and related conical intersections in the benzene radical cation and the monofluoro derivate
J. Molec. Struct.
838
(2007) 94-99
I. Baldea and L. S. Cederbaum
Hidden quasisymmetry in the optical absorption of quantum dot nanorings
Phys. Rev. B
75
(2007) 125323 (selected for the April 9, 2007 issue of Virtual Journal of Nanoscale Science & Technology, http://www.vjnano.org)
I. Baldea and H. Koeppel
Multistate multimode vibronic dynamics: Entanglement of electronic and vibrational degrees of freedom in the benzene radical cation
J. Chem. Phys.
124
(2006) 064101
I. Baldea, J. Franz, P. G. Szalay, and H. Koeppel
Multi-mode vibronic interactions in the five lowest electronic states of the fluorobenzene radical cation
Chem. Phys.
329
(2006) 65-75
I. Baldea, A. K. Gupta, L. S. Cederbaum, and N. Moiseyev
High-harmonic generation by quantum-dot nanorings
Phys. Rev. B.
69
(2004) 245311 (selected for Virtual Journal of Nanoscale Science & Technology, http://www.vjnano.org)
I. Baldea and H. Koeppel
Three-dimensional vibronic analysis of the B system of Na
3
Eur. Phys. J. D - Atomic, Molecular, Optical and Plasma Physics
30
(2004) 209-215
I. Baldea, H. Koeppel, and L. S. Cederbaum
Impact of phonons on quantum phase transitions in nanorings of coupled quantum dots
Phys. Rev. B
69
(2004) 075307 (selected for Virtual Journal of Nanoscale Science & Technology, http://www.vjnano.org)
H. Koeppel, I. Baldea, and P. G. Szalay
Combined Jahn-Teller and Pseudo-Jahn-Teller Effects in the Benzene Radical Cation
Adv. Quant. Chem..
44
(2003) 199-217
I. Baldea and L. S. Cederbaum
Orbital Picture of Ionization and Its Breakdown in Nanoarrays of Quantum Dots
Phys. Rev. Lett..
89
(2002) 133003 (selected for Virtual Journal of Nanoscale Science & Technology,
6
(12) (14 Sept, 2002))
H. Koeppel, M. Doescher, I. Baldea, H.-D. Meyer, and P. G. Szalay
Multistate vibronic interactions in the benzene radical cation. II. Quantum dynamical simulations
J. Chem. Phys.
117
(2002) 2657-2671
I. Baldea, H. Koeppel, and L. S. Cederbaum
Tunneling-driven quantum phase transitions in mesoscopic commensurate systems
Synthetic Metals
119
(2001) 561
I. Baldea, H. Koeppel, and L. S. Cederbaum
Collective quantum tunneling of strongly correlated electrons in commensurate mesoscopic rings
Eur. Phys. J. B
20
(2001) 289-299
I. Baldea, H. Koeppel, and L. S. Cederbaum
Symmetry-adapted BCS-type trial wave functions for mesoscopic rings
Phys. Rev. B
63
(2001) 155308 (selected for Virtual Journal of Nanoscale Science & Technology, http://www.vjnano.org)
I. Baldea, H. Koeppel, and L. S. Cederbaum
Tunneling-driven quantum phase transitions in mesoscopic commensurate systems of strongly correlated electrons
Solid State Commun.
115
(2000) 593-597
I. Baldea, H. Koeppel, and L. S. Cederbaum
Structural and magnetic transitions in ensembles of mesoscopic Peierls rings in a magnetic flux
Phys. Rev. B
60
(1999) 6646-6654
I. Baldea, H. Koeppel, L. S. Cederbaum
Quantum Phonon Fluctuations in Mesoscopic Dimerized Systems
J. Phys. Soc. Jpn.
68
(1999) 1954-1962
I. Baldea and H. Koeppel and L. S. Cederbaum
Electronic and lattice excitations in nonuniform one-dimensional clusters
Synthetic Metals
102
(1999) 1581-1584
I. Baldea, H. Koeppel, and L. S. Cederbaum
Structural change in mesoscopic Peierls chains
Synthetic Metals
101
(1999) 394-397
I. Baldea, H. Koeppel, and L. S. Cederbaum
Quantum phonon fluctuations in mesoscopic Peierls rings threaded by a magnetic flux
Synthetic Metals
101
(1999) 345-346
I. Baldea, H. Koeppel, and L. S. Cederbaum
Interplay between dia- and paramagnetism in ensembles of mesoscopic Peierls rings in a magnetic flux
Solid State Commun.
108
(1998) 607-612
I. Baldea, H. Koeppel, L. S. Cederbaum
How small can a Peierls dimerized chain be?
Solid State Commun.
106
(1998) 733-737
I. Baldea, H. Koeppel, and L. S. Cederbaum
The smooth structural change in mesoscopic Peierls chains
Eur. Phys. J. B
3
(1998) 507-515
I. Baldea, H. Koeppel, and L. S. Cederbaum
Finite-size effects and quantum phonon fluctuations in the optical absorption edge of dimerized chains
Phys. Rev. B
55
(1997) 1481-1485
I. Baldea, H. Koeppel, and L. S. Cederbaum
Weak pinning of the charge-density wave revisited
Synthetic Metals
86
(1997) 2225
I. Baldea, H. Koeppel and L. S. Cederbaum
Electron-phonon coupling in a one-band MX-chain model. A numerical study
Synthetic Metals
86
(1997) 2221
I. Baldea and L. S. Cederbaum, and H. Koeppel
Effect of quantum phonon fluctuations on optical properties of finite semiconducting chains. Adiabatic and nonadiabatic results
Synthetic Metals
85
(1997) 1101
I. Baldea, L. S. Cederbaum, and H. Koeppel
Analytical Explanation for Numerical Simulation Results on CDW
J. Phys. Soc. Jpn.
64
(1995) 356-359
I. Baldea, H. Koeppel and L. S. Cederbaum
Analytical results in CDW systems beyond the strong pinning limit
Solid State Commun.
93
(1995) 817-821
W. Aichmann and I. Baldea
The role of life-time effects in pinned CDW systems
Solid State Commun.
93
(1995) 183-187
I. Baldea, H. Koeppel and L. S. Cederbaum
Coexistence of short- and large-scale phase variations in a charge-density wave weakly coupled to impurities
Phys. Rev. B
52
(1995) 11845-11852
I. Baldea
Individual versus collective pinning in charge-density-wave systems with impurties
Phys. Rev. B
51
(1995) 1495-1506
I. Baldea
Interplay between life-time and pinning effects in alloyed CDW systems
Solid State Commun.
90
(1994) 717-721
I. Baldea and M. Anghel
Impurity effect on the two-dimensional spin density wave
Physica Scripta
48
(1993) 497
I. Baldea and M. Badescu
Quasiregular impurity distribution driven by a charge-density wave
Phys. Rev. B
48
(1993) 8619-8628
W. Aichmann and I. Baldea
Life-Time and Pinning Effects in CDW Systems
J. de Physique IV (Paris) C-2
3
(1993) 71-74
I. Baldea and M. Badescu
Interplay Between Disorder and Quasi--Regularity in CDW Systems
J. de Physique IV (Paris) C-2
3
3 369-372
I. Baldea
Possible correlation of the anomalous thermal behavior of NbSe
3
to mobile defects
Mod. Phys. Lett. B
5
(1991) 1013-1017
I. Baldea
Reentrant charge-density wave in the one-dimensional system with impurities - A self-consistent approach
Physica Scripta
42
(1990) 749
I. Baldea
On the gapless charge-density wave state of heavily ClO
4
-doped polyacetylene
Synthetic Metals
38
(1990) 253-257
I. Baldea and M. Badescu
On the effect of impurities in the one-dimensional electron-phonon system
Physica Scripta
40
(1989)
I. Baldea
Spin susceptibility of doped CDW system
Solid State Commun.
66
(1988) 1205-1209
I. Baldea
Effect of a Statistical Distribution of the Fermi Wave Vector Values in One-Dimensional Electron-Phonon System
Rev. roum. phys.
33
(1988) 69-79
I. Baldea
On the properties of the quasi-one-dimensional compound NbSe
3
doped with tantalum
Synthetic Metals
20
(1987) 379-381
I. Baldea
Phenomenological Treatment of the Departure from the Picture of Ideal One-Dimensional Conductor
phys. stat. solidi (b)
143
(1987) 557-567
I. Baldea
Interplay between disorder and 2k
F
-regularity of the impurity distribution in the Peierls-CDW state
Solid State Commun.
63
(1987) 5-8
I. Baldea
An effect of the Peierls lattice distortion on the impurity distribution
Solid State Commun.
61
(1987) 279-283
I. Baldea and M. Apostol
Pseudo-gap model for KCP. Application to the near infrared conductivity
Physica B+C
143
(1986) 276-278
I. Baldea
2 k
F
-Distortion of the Impurity Distribution in the Peierls-CDW State
phys. stat. solidi (b)
138
(1986) 309-319
I. Baldea
Theory of Interacting Fermion Systems with Application to One-Dimensional Materials
Stud. Cerc. Fiz.
38
(1986) 572-585
I. Baldea
Description of the Overhauser State of the Nuclear/Neutron Star Matter
Rev. Roum. Phys.
31
(1986) 617-630
I. Baldea
The One-Dimensional Electron-Phonon System with Forward Scattering Interaction
Physica Scripta
31
(1985) 606
I. Baldea and M. Apostol
Modulated-impurity mechanism of pinning in KCP
J. Phys. C: Solid State Physics
18
(1985) 6135
M. Apostol and I. Baldea
Incommensurate pinning mechanism in KCP
Solid State Commun.
53
(1985) 687-690
I. Baldea
An Extended Tomonaga-Luttinger Model
Rev. Roum. Phys.
30
(1985) 723-736
I. Baldea
Properties of the Quasi-One-Dimensional Material KCP (Structural, Electrical and Optical Properties)
Stud. Cerc. Fiz.
37
(1985) 147-175
M. Apostol and I. Baldea
On the Charge-Density Wave State in the Quasi-One-Dimensional Compound K
2
[Pt(CN)
4
Br
0.3
x 3.2 H
2
O (KCP)
Rev. Roum. Phys.
30
(1985) 605-630
I. Baldea and M. Apostol
Far Infrared Conductivity in KCP
Molec. Cryst. Liq. Cryst.
120
(1985) 397-400
M. Apostol and I. Baldea
On the Lattice Excitations in KCP
Molec. Cryst. Liq. Cryst.
120
(1985) 393-396
I. Baldea
Ward Identities For Non-Relativistic Fermion Systems
Stud. Cerc. Fiz.
36
(1984) 587-606
I. Baldea and M. Apostol
Electron-Phonon Coupling in KCP
J. de Physique (Paris) C-3
44
(1983) 1557-1559
M. Apostol, I. Baldea, and A. Corciovei
On Giant Kohn Anomaly in Solids with One-Dimensional Properties
Rev. Roum. Phys.
27
(1982) 753-759
M. Apostol and I. Baldea
Electron-phonon coupling in one dimension
J. Phys. C: Solid State Physics
15
(1982) 3319
M. Apostol and I. Baldea
One-electron Green function for electrons coupled with acoustical phonons in one dimension
Phys. Lett. A
88
(1982) 73-76
D. E. Brancus, I. Baldea, and I. A. Dorobantu
Thermalization and Linear Response of Non-Equilibrium Landau Electrons
Rev. Roum. Phys.
25
(1980) 83-91
D. E. Demco, I. Baldea, and D. Barb
Nuclear Magnetic Relaxation in Superconducting Materials
Stud. Cerc. Fiz.
29
(1977) 59-82
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