@article{UBHD-68291946,
  author={Bâldea, Ioan and K{\"o}ppel, Horst and Wenzel, Wolfgang},
  title={(4,4′)-Bipyridine in vacuo and in solvents},
  subtitle={a quantum chemical study of a prototypical floppy molecule from a molecular transport perspective},
  year={2013},
  pages={1918-1928},
  language={eng},
  issn={1463-9084},
  volume={15},
  number={6},
  note={The article was received on 13 Oct 2012, accepted on 21 Nov 2012 and first published on 22 November 2012 ; Gesehen am 03.08.2018},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/C2CP43627B},
}
@article{UBHD-68291899,
  author={Bâldea, Ioan},
  title={Ambipolar transition voltage spectroscopy},
  subtitle={analytical results and experimental agreement},
  year={2012},
  pages={1-5},
  language={eng},
  issn={1550-235X},
  volume={85},
  note={Gesehen am 03.08.2018},
  journal={Physical review},
  doi={10.1103/PhysRevB.85.035442},
}
@article{UBHD-69187170,
  author={Bâldea, Ioan},
  title={Antioxidant activity via free radical scavenging of pitavastatin and its hydroxylated derivatives},
  subtitle={a quantum chemical attempt aiming to assist drug development},
  year={2024},
  pages={1-12},
  language={eng},
  issn={2513-0390},
  volume={7},
  number={Artikel-ID 2301123},
  note={Gesehen am 20.02.2024 ; Early view, online version of record before inclusion in an issue, open access},
  journal={Advanced theory and simulations},
  doi={10.1002/adts.202301123},
}
@article{UBHD-68989548,
  author={Bâldea, Ioan and K{\"o}ppel, Horst and Maul, Robert and Wenzel, Wolfgang},
  title={Applying the extended molecule approach to correlated electron transport},
  subtitle={important insight from model calculations},
  year={2010},
  pages={1-12},
  language={eng},
  issn={1089-7690},
  volume={133},
  note={Gesehen am 28.11.2022},
  journal={The journal of chemical physics},
  doi={10.1063/1.3455056},
}
@article{UBHD-69244180,
  author={Bâldea, Ioan and Chen, Yuhong and Zhang, Miao and Xin, Na and Feng, Yunxia and Feng, Jiajun and Jia, Chuancheng and Guo, Xuefeng and Xie, Zuoti},
  title={Breakdown of Ohm’s law in molecular junctions with electrodes of single-layer graphene},
  year={2024},
  pages={3267-3275},
  language={eng},
  issn={1948-7185},
  volume={15},
  number={12 vom: M{\"a}rz},
  note={Online ver{\"o}ffentlicht: 15. M{\"a}rz 2024 ; Gesehen am 16.08.2024},
  journal={The journal of physical chemistry letters},
  doi={10.1021/acs.jpclett.4c00387},
}
@article{UBHD-69217342,
  author={Bâldea, Ioan},
  title={Can tunneling current in molecular junctions be so strongly temperature dependent to challenge a hopping mechanism?},
  subtitle={Analytical formulas answer this question and provide important insight into large area junctions},
  year={2024},
  pages={6540-6556},
  language={eng},
  issn={1463-9084},
  volume={26},
  number={8},
  note={Zuerst ver{\"o}ffentlicht: 08. Dezember 2023 ; Gesehen am 24.05.2024},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/D3CP05046G},
}
@article{UBHD-69032543,
  author={Bâldea, Ioan},
  title={Chemical bonding in representative astrophysically relevant neutral, cation, and anion HCnH chains},
  year={2022},
  pages={1-23},
  language={eng},
  issn={1741-4199},
  volume={31},
  number={Artikel-ID 123101},
  note={In der chemischen Formel erscheint das n tiefgestellt ; Gesehen am 01.02.2023},
  journal={Chinese physics},
  doi={10.1088/1674-1056/ac9b04},
}
@article{UBHD-69217344,
  author={Bâldea, Ioan},
  title={Comment on “A single level tunneling model for molecular junctions},
  subtitle={evaluating the simulation methods” by E. M. Opodi, X. Song, X. Yu and W. Hu, Phys. Chem. Chem. Phys., 2022, 24, 11958”},
  year={2024},
  pages={7230-7235},
  language={eng},
  issn={1463-9084},
  volume={26},
  number={8},
  note={Gesehen am 24.05.2024},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/D2CP05110A},
}
@article{UBHD-68640380,
  author={Bâldea, Ioan},
  title={Concurrent conductance and transition voltage spectroscopy study of scanning tunneling microscopy vacuum junctions},
  subtitle={Does it unravel new physics?},
  year={2014},
  pages={33257-33261},
  language={eng},
  issn={2046-2069},
  volume={4},
  number={63},
  note={Gesehen am 25.09.2020},
  journal={RSC Advances},
  doi={10.1039/C4RA04648J},
}
@article{UBHD-68621750,
  author={Bâldea, Ioan},
  title={Counterintuitive issues in the charge transport through molecular junctions},
  year={2015},
  pages={31260-31269},
  language={eng},
  issn={1463-9084},
  volume={17},
  number={46},
  note={Gesehen am 29.07.2020},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/C5CP05476A},
}
@article{UBHD-69006986,
  author={Bâldea, Ioan},
  title={Critical analysis of radical scavenging properties of atorvastatin in methanol recently estimated via density functional theory},
  year={2022},
  pages={1-7},
  language={eng},
  issn={2210-271X},
  volume={1217(2022) vom: Nov.},
  number={Artikel-ID 113898},
  note={Version vom 17. Oktober 2022 ; Gesehen am 07.11.2023},
  journal={Computational and theoretical chemistry},
  doi={10.1016/j.comptc.2022.113898},
}
@article{UBHD-67562582,
  author={Bâldea, Ioan},
  title={Demonstrating why DFT-calculations for molecular transport in solvents need scissor corrections},
  year={2013},
  pages={19-21},
  language={eng},
  issn={1388-2481},
  volume={36},
  journal={Electrochemistry communications},
}
@article{UBHD-68667609,
  author={Bâldea, Ioan},
  title={Demonstrating why DFT-calculations for molecular transport in solvents need scissor corrections},
  year={2013},
  pages={19-21},
  language={eng},
  issn={1873-1902},
  volume={36},
  note={Gesehen am 01.12.2020},
  journal={Electrochemistry communications},
  doi={10.1016/j.elecom.2013.08.027},
}
@article{UBHD-69213295,
  author={Bâldea, Ioan},
  title={Dichotomy between level broadening and level coupling to electrodes in large area EGaIn molecular junctions},
  year={2024},
  pages={2916-2921},
  language={eng},
  issn={1948-7185},
  volume={15},
  number={10},
  note={Gesehen am 14.05.2024},
  journal={The journal of physical chemistry letters},
  doi={10.1021/acs.jpclett.4c00386},
}
@article{UBHD-68291649,
  author={Bâldea, Ioan},
  title={Effects of stochastic fluctuations at molecule-electrode contacts in transition voltage spectroscopy},
  year={2012},
  pages={65-71},
  language={eng},
  volume={400},
  note={Available online 1 March 2012 ; Gesehen am 02.08.2018},
  journal={Chemical physics},
  doi={10.1016/j.chemphys.2012.02.011},
}
@article{UBHD-68650139,
  author={Bâldea, Ioan},
  title={Electrochemical setup},
  subtitle={a unique chance to simultaneously control orbital energies and vibrational properties of single-molecule junctions with unprecedented efficiency},
  year={2014},
  pages={25942-25949},
  language={eng},
  issn={1463-9084},
  volume={16},
  number={47},
  note={Gesehen am 19.10.2020},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/C4CP04316B},
}
@article{UBHD-69010503,
  author={Bâldea, Ioan},
  title={Estimating the number of molecules in molecular junctions merely based on the low bias tunneling conductance at variable temperature},
  year={2022},
  pages={1-20},
  language={eng},
  issn={1422-0067 and 1661-6596},
  volume={23},
  note={Gesehen am 08.11.2023},
  journal={International journal of molecular sciences},
  doi={10.3390/ijms232314985},
}
@article{UBHD-68291939,
  author={Bâldea, Ioan and K{\"o}ppel, Horst},
  title={Evidence on single-molecule transport in electrostatically-gated molecular transistors},
  year={2012},
  pages={1472-1476},
  language={eng},
  issn={1873-2429},
  volume={376},
  number={17},
  note={Available online 12 March 2012 ; Gesehen am 03.08.2018},
  journal={Physics letters},
  doi={10.1016/j.physleta.2012.03.021},
}
@article{UBHD-68503747,
  author={Bâldea, Ioan},
  title={Evidence that molecules in molecular junctions may not be subject to the entire external perturbation applied to electrodes},
  year={2020},
  pages={1329-1337},
  language={eng},
  issn={1520-5827},
  volume={36},
  number={5},
  note={Gesehen am 11.03.2020},
  journal={Langmuir},
  doi={10.1021/acs.langmuir.9b03430},
}
@article{UBHD-68291648,
  author={Bâldea, Ioan},
  title={Extending the Newns-Anderson model to allow nanotransport studies through molecules with floppy degrees of freedom},
  year={2012},
  pages={47002p1-47002p6},
  language={eng},
  issn={1286-4854},
  volume={99},
  number={4},
  note={Published online 8 August 2012 ; Gesehen am 02.08.2018},
  journal={epl},
  doi={10.1209/0295-5075/99/47002},
}
@article{UBHD-68668942,
  author={Bâldea, Ioan},
  title={Extensive quantum chemistry study of neutral and charged C4N chains},
  subtitle={anattempt to aid astronomical observations},
  year={2020},
  pages={434-448},
  language={eng},
  issn={2472-3452},
  volume={4},
  number={3},
  note={Gesehen am 03.12.2020 ; Im Titel ist die Ziffer "4" tiefgestellt},
  journal={ACS earth and space chemistry},
  doi={10.1021/acsearthspacechem.9b00321},
}
@article{UBHD-68291909,
  author={Bâldea, Ioan},
  title={Floppy molecules as candidates for achieving optoelectronic molecular devices without skeletal rearrangement or bond breaking},
  year={2017},
  pages={30842-30851},
  language={eng},
  issn={1463-9084},
  volume={19},
  number={45},
  note={The article was received on 20 Sep 2017, accepted on 08 Nov 2017 and first published on 08 Nov 2017 ; Gesehen am 03.08.2018},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/C7CP06428D},
}
@article{UBHD-68628760,
  author={Bâldea, Ioan},
  title={Fractional molecular charge studied via molecular vibrational properties},
  subtitle={specific aspects in Jahn-Teller active molecular species},
  year={2016},
  pages={93715-93721},
  language={eng},
  issn={2046-2069},
  volume={6},
  number={96},
  note={Gesehen am 19.08.2020},
  journal={RSC Advances},
  doi={10.1039/C6RA21476B},
}
@article{UBHD-68936386,
  author={Bâldea, Ioan},
  title={HCnH- anion chains with n ≤ 8 are nonlinear and their permanent dipole makes them potential candidates for astronomical observation},
  year={2022},
  pages={1-12},
  language={eng},
  issn={1420-3049},
  volume={27},
  note={Published: 12 May 2022 ; Das "-" ist bei HCnH- hochgestellt, das "n" bei HCnH- ist tiefgestellt ; Gesehen am 30.06.2022},
  journal={Molecules},
  doi={10.3390/molecules27103100},
}
@article{UBHD-68404454,
  author={Bâldea, Ioan},
  title={Impact of molecular conformation on transport and transport-related properties at the nanoscale},
  year={2019},
  pages={593-600},
  language={eng},
  volume={487},
  note={Gesehen am 04.07.2019},
  journal={Applied surface science},
  doi={10.1016/j.apsusc.2019.05.112},
}
@article{UBHD-68621753,
  author={Bâldea, Ioan},
  title={An important impact of the molecule-electrode coupling asymmetry on the efficiency of bias-driven redox processes in molecular junctions},
  year={2015},
  pages={15756-15763},
  language={eng},
  issn={1463-9084},
  volume={17},
  number={24},
  note={Gesehen am 29.07.2020},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/C5CP01805F},
}
@article{UBHD-68621752,
  author={Bâldea, Ioan},
  title={Important issues facing model-based approaches to tunneling transport in molecular junctions},
  year={2015},
  pages={20217-20230},
  language={eng},
  issn={1463-9084},
  volume={17},
  number={31},
  note={Gesehen am 29.07.2020},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/C5CP02595H},
}
@article{UBHD-68628753,
  author={Bâldea, Ioan},
  title={Important impact of the experimental platform on the efficient control of electronic and vibrational properties of molecular junctions},
  year={2016},
  pages={685-691},
  language={eng},
  volume={13},
  number={8-9},
  note={Gesehen am 19.08.2020},
  journal={International journal of nanotechnology},
  doi={10.1504/IJNT.2016.079672},
}
@article{UBHD-68291916,
  author={Bâldea, Ioan},
  title={Important issues related to the law of corresponding states for the charge transport in molecular junctions with graphene electrodes},
  year={2017},
  pages={19-23},
  language={eng},
  volume={49},
  note={Available online 16 June 2017 ; Gesehen am 03.08.2018},
  journal={Organic electronics},
  doi={10.1016/j.orgel.2017.06.039},
}
@article{UBHD-67562583,
  author={Bâldea, Ioan},
  title={Important insight into electron transfer in single-molecule junctions based on redox metalloproteins from transition voltage spectroscopy},
  year={2013},
  pages={25798-25804},
  language={eng},
  issn={1932-7447},
  volume={117},
  number={48},
  journal={The journal of physical chemistry},
}
@article{UBHD-68667619,
  author={Bâldea, Ioan},
  title={Important insight into electron transfer in single-molecule junctions based on redox metalloproteins from transition voltage spectroscopy},
  year={2013},
  pages={25798-25804},
  language={eng},
  issn={1932-7455},
  volume={117},
  number={48},
  note={Gesehen am 01.12.2020},
  journal={The journal of physical chemistry},
  doi={10.1021/jp408873c},
}
@article{UBHD-68291652,
  author={Bâldea, Ioan},
  title={Interpretation of stochastic events in single-molecule measurements of conductance and transition voltage spectroscopy},
  year={2012},
  pages={7958-7962},
  language={eng},
  issn={1520-5126},
  volume={134},
  number={18},
  note={Publication Date (Web): April 17, 2012 ; Gesehen am 02.08.2018},
  journal={Journal of the American Chemical Society},
  doi={10.1021/ja302248h},
}
@article{UBHD-68628748,
  author={Bâldea, Ioan},
  title={Invariance of molecular charge transport upon changes of extended molecule size and several related issues},
  year={2016},
  pages={418-431},
  language={eng},
  issn={2190-4286},
  volume={7},
  note={Gesehen am 19.08.2020},
  journal={Beilstein journal of nanotechnology},
  doi={10.3762/bjnano.7.37},
}
@article{UBHD-68495211,
  author={Bâldea, Ioan},
  title={Long carbon-based chains of interstellar medium can have a triplet ground state},
  subtitle={why is this important for astrochemistry?},
  year={2019},
  pages={863-872},
  language={eng},
  issn={2472-3452},
  volume={3},
  number={5},
  note={Gesehen am 02.03.2020},
  journal={ACS earth and space chemistry},
  doi={10.1021/acsearthspacechem.9b00008},
}
@article{UBHD-68358312,
  author={Bâldea, Ioan},
  title={A novel route to get functionality in nanoelectronics},
  subtitle={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},
  year={2019},
  pages={16-21},
  language={eng},
  volume={472},
  note={Available online 27 July 2018 ; Gesehen am 13.02.2019},
  journal={Applied surface science},
  doi={10.1016/j.apsusc.2018.07.155},
}
@article{UBHD-68291933,
  author={Bâldea, Ioan and K{\"o}ppel, Horst},
  title={A physical limitation of the Wigner "distribution" function in molecular transport},
  year={2012},
  pages={1645-1646},
  language={eng},
  issn={1873-2429},
  volume={376},
  number={19},
  note={Available online 29 March 2012 ; Gesehen am 03.08.2018},
  journal={Physics letters},
  doi={10.1016/j.physleta.2012.03.054},
}
@article{UBHD-68672203,
  author={Bâldea, Ioan},
  title={Profiling astrophysically relevant MgC4H chains},
  subtitle={an attempt to aid astronomical observations},
  year={2020},
  pages={4316-4326},
  language={eng},
  issn={1365-2966},
  volume={498},
  number={3},
  note={Gesehen am 11.12.2020 ; Im Titel ist die Ziffer "4" tiefgestellt},
  journal={Monthly notices of the Royal Astronomical Society},
  doi={10.1093/mnras/staa2354},
}
@article{UBHD-68668959,
  author={Bâldea, Ioan},
  title={Profiling C4N radicals of astrophysical interest},
  year={2020},
  pages={2506-2510},
  language={eng},
  issn={1365-2966},
  volume={493},
  number={2},
  note={Gesehen am 03.12.2020 ; Im Titel ist die Ziffer "4" tiefgestellt},
  journal={Monthly notices of the Royal Astronomical Society},
  doi={10.1093/mnras/staa455},
}
@article{UBHD-68291918,
  author={Bâldea, Ioan},
  title={Protocol for disentangling the thermally activated contribution to the tunneling-assisted charge transport},
  subtitle={analytical results and experimental relevance},
  year={2017},
  pages={11759-11770},
  language={eng},
  issn={1463-9084},
  volume={19},
  number={19},
  note={The article was received on 18 Feb 2017, accepted on 04 Apr 2017 and first published on 06 Apr 2017 ; Gesehen am 03.08.2018},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/C7CP01103B},
}
@article{UBHD-68623907,
  author={Bâldea, Ioan},
  title={Quantifying the relative molecular orbital alignment for molecular junctions with similar chemical linkage to electrodes},
  year={2014},
  language={eng},
  issn={1361-6528},
  volume={25(2014) Artikel-Nummer 455202},
  note={Gesehen am 04.08.2020},
  journal={Nanotechnology},
  doi={10.1088/0957-4484/25/45/455202},
}
@incollection{UBHD-68703318,
  author={Bâldea, Ioan},
  title={A quantum chemical study from a molecular transport perspective},
  subtitle={ionization and electron attachment energies for species often used to fabricate single-molecule junctions},
  year={2014},
  pages={37-56},
  language={eng},
  note={Gesehen am 24.02.2021},
  booktitle={Organic photonics and electronics},
  editor={Skabara, Peter},
  doi={10.1039/C4FD00101J},
}
@article{UBHD-68899640,
  author={Bâldea, Ioan and K{\"o}ppel, Horst},
  title={Reply to "Comment on "Critical analysis of a variational method used to describe molecular electron transport""},
  year={2011},
  pages={1-7},
  language={eng},
  issn={1550-235X},
  volume={84},
  note={Gesehen am 25.03.2022},
  journal={Physical review},
  doi={10.1103/PhysRevB.84.037305},
}
@article{UBHD-68989013,
  author={Bâldea, Ioan},
  title={Revealing molecular orbital gating by transition voltage spectroscopy},
  year={2010},
  pages={15-20},
  language={eng},
  volume={377},
  number={1},
  note={Gesehen am 25.11.2022},
  journal={Chemical physics},
  doi={10.1016/j.chemphys.2010.08.009},
}
@article{UBHD-68989526,
  author={Bâldea, Ioan and K{\"o}ppel, Horst},
  title={Single-electron transistors studied by microwave and far-infrared absorption},
  subtitle={theoretical results and experimental proposal},
  year={2010},
  pages={1-22},
  language={eng},
  issn={1550-235X},
  volume={81},
  number={Artikel-ID 125322},
  note={Gesehen am 28.11.2022},
  journal={Physical review},
  doi={10.1103/PhysRevB.81.125322},
}
@article{UBHD-68633619,
  author={Bâldea, Ioan},
  title={Single-molecule junctions based on bipyridine},
  subtitle={impact of an unusual reorganization on charge transport},
  year={2014},
  pages={8676-8684},
  language={eng},
  issn={1932-7455},
  volume={118},
  number={16},
  note={Gesehen am 01.09.2020},
  journal={The journal of physical chemistry},
  doi={10.1021/jp412675k},
}
@article{UBHD-68989509,
  author={Bâldea, Ioan and K{\"o}ppel, Horst},
  title={Sources of negative differential resistance in electric nanotransport},
  year={2010},
  pages={1-4},
  language={eng},
  issn={1550-235X},
  volume={81},
  note={Gesehen am 28.11.2022},
  journal={Physical review},
  doi={10.1103/PhysRevB.81.193401},
}
@article{UBHD-68415721,
  author={Bâldea, Ioan},
  title={Specific issues related to the law of corresponding states for the charge transport in molecular junctions based on graphene electrodes},
  year={2019},
  pages={256-261},
  language={eng},
  volume={474},
  note={Available online 16 February 2018 ; Gesehen am 05.08.2019},
  journal={Applied surface science},
  doi={10.1016/j.apsusc.2018.02.149},
}
@article{UBHD-68496122,
  author={Bâldea, Ioan},
  title={A sui generis electrode-driven spatial confinement effect responsible for strong twisting enhancement of floppy molecules in closely packed self-assembled monolayers},
  year={2018},
  pages={23492-23499},
  language={eng},
  issn={1463-9084},
  volume={20},
  number={36},
  note={Gesehen am 04.03.2020 ; Im Titel ist der Begriff "sui generis" kursiv geschrieben},
  journal={Physical chemistry, chemical physics},
  doi={10.1039/C8CP04974B},
}
@article{UBHD-68291926,
  author={Bâldea, Ioan},
  title={Supporting information for vibrational frequencies of fractionally charged molecular species},
  subtitle={benchmarking DFT results against ab initio calculations},
  year={2017},
  pages={2282-2287},
  language={eng},
  issn={1520-5215},
  volume={121},
  number={11},
  note={Published online13 March 2017 ; Gesehen am 03.08.2018},
  journal={The journal of physical chemistry},
  doi={10.1021/acs.jpca.6b12946},
}
@article{UBHD-68770979,
  author={Bâldea, Ioan},
  title={Suppression of groups intermingling as an appealing option for flattening and delaying the epidemiological curve while allowing economic and social life at a bearable level during the COVID-19 pandemic},
  year={2020},
  pages={1-8},
  language={eng},
  issn={2513-0390},
  volume={3},
  note={Gesehen am 16.08.2021},
  journal={Advanced theory and simulations},
  doi={10.1002/adts.202000132},
  url={https://doi.org/10.1002/adts.202000132},
  library={UB},
}
@incollection{UBHD-68284485,
  author={Bâldea, Ioan},
  title={A surprising way to control the charge transport in molecular electronics},
  subtitle={the subtle impact of the coverage of self-assembled monolayers of floppy molecules adsorbed on metallic electrodes},
  year={2017},
  pages={35-52},
  language={eng},
  note={Gesehen am 11.07.2018 ; Received 10th March 2017, Accepted 19th May 2017},
  booktitle={Complex molecular surfaces and interfaces},
  doi={10.1039/C7FD00101K},
}
@article{UBHD-68291895,
  author={Bâldea, Ioan},
  title={Transition voltage spectroscopy in vacuum break junction},
  subtitle={possible role of surface states},
  year={2012},
  pages={17010p1-p6},
  language={eng},
  issn={1286-4854},
  volume={98},
  number={1},
  note={Gesehen am 03.08.2018 ; received 16 January 2012; accepted in final form 11 March 2012; published online 12 April 2012},
  journal={epl},
  doi={10.1209/0295-5075/98/17010},
}
@article{UBHD-68291641,
  author={Bâldea, Ioan},
  title={Transition voltage spectroscopy},
  subtitle={Artefacts of the Simmons approach},
  year={2012},
  pages={1151-1153},
  language={eng},
  volume={73},
  number={9},
  note={Available online 14 May 2012 ; Gesehen am 02.08.2018},
  journal={Journal of physics and chemistry of solids},
  doi={10.1016/j.jpcs.2012.05.006},
}
@article{UBHD-68291930,
  author={Bâldea, Ioan and K{\"o}ppel, Horst},
  title={Transition voltage spectroscopy in vacuum break junction},
  subtitle={the standard tunneling barrier model and beyond},
  year={2012},
  pages={1791-1804},
  language={eng},
  issn={1521-3951},
  volume={249},
  number={9},
  note={Published online 17 May 2012 ; Gesehen am 03.08.2018},
  journal={Physica status solidi},
  doi={10.1002/pssb.201248034},
}
@article{UBHD-68667613,
  author={Bâldea, Ioan},
  title={Transition voltage spectroscopy reveals significant solvent effects on molecular transport and settles an important issue in bipyridine-based junctions},
  year={2013},
  pages={9222-9230},
  language={eng},
  issn={2040-3372},
  volume={5},
  number={19},
  note={Gesehen am 01.12.2020},
  journal={Nanoscale},
  doi={10.1039/C3NR51290H},
}
@article{UBHD-68628756,
  author={Bâldea, Ioan},
  title={Tuning the conformation of floppy molecules by charge transfer},
  year={2016},
  pages={111903-111907},
  language={eng},
  issn={2046-2069},
  volume={6},
  number={113},
  note={Gesehen am 19.08.2020},
  journal={RSC Advances},
  doi={10.1039/C6RA23848C},
}
@article{UBHD-69028386,
  author={Bâldea, Ioan},
  title={Two theorems and important insight on how the preferred mechanism of free radical scavenging cannot be settled},
  subtitle={comment on Pandithavidana, D.R.; Jayawardana, S.B. : comparative study of antioxidant potential of selected dietary vitamins; Computational Insights. Molecules 2019, 24, 1646},
  year={2022},
  pages={1-16},
  language={eng},
  issn={1420-3049},
  volume={27},
  note={Gesehen am 31.01.2023},
  journal={Molecules},
  doi={10.3390/molecules27228092},
}
@article{UBHD-68621755,
  author={Bâldea, Ioan and Xie, Zuoti and Frisbie, C. Daniel},
  title={Uncovering a law of corresponding states for electron tunneling in molecular junctions},
  year={2015},
  pages={10465-10471},
  language={eng},
  issn={2040-3372},
  volume={7},
  number={23},
  note={Gesehen am 29.07.2020},
  journal={Nanoscale},
  doi={10.1039/C5NR02225H},
}
@article{UBHD-68291941,
  author={Bâldea, Ioan},
  title={Vibrational properties of fractionally charged molecules and their relevance for molecular electronics and electrochemistry},
  year={2017},
  pages={311-318},
  language={eng},
  volume={482},
  note={Available online 26 August 2016 ; Gesehen am 03.08.2018},
  journal={Chemical physics},
  doi={10.1016/j.chemphys.2016.08.024},
}
@article{UBHD-69064566,
  author={Bâldea, Ioan},
  title={What can we learn from the time evolution of COVID-19 epidemic in Slovenia?},
  year={2021},
  pages={1-8},
  language={eng},
  issn={2513-0390},
  volume={4},
  note={Gesehen am 12.04.2023},
  journal={Advanced theory and simulations},
  doi={10.1002/adts.202000225},
  url={https://doi.org/10.1002/adts.202000225},
  library={UB},
}
@article{UBHD-68882524,
  author={Bâldea, Ioan},
  title={Why asymmetric molecular coupling to electrodes cannot be at work in real molecular rectifiers},
  year={2021},
  pages={1-9},
  language={eng},
  issn={2469-9969},
  volume={103},
  note={Gesehen am 24.02.2022},
  journal={Physical review},
  doi={10.1103/PhysRevB.103.195408},
}
@article{UBHD-68967810,
  author={Bâldea, Ioan},
  title={Why ortho- and para-hydroxy metabolites can scavenge free radicals that the parent Atorvastatin cannot?},
  subtitle={important pharmacologic insight from quantum chemistry},
  year={2022},
  pages={1-28},
  language={eng},
  issn={1420-3049},
  volume={27},
  journal={Molecules},
  doi={10.3390/molecules27155036},
}
@article{UBHD-69238071,
  author={Chen, Yuhong and Bâldea, Ioan and Yu, Yongxin and Liang, Zining and Li, Ming-De and Koren, Elad and Xie, Zuoti},
  title={CP-AFM molecular tunnel junctions with alkyl backbones anchored using alkynyl and thiol groups},
  subtitle={microscopically different despite phenomenological similarity},
  year={2024},
  pages={4410-4423},
  language={eng},
  issn={1520-5827},
  volume={40},
  number={8 vom: Feb.},
  note={Online ver{\"o}ffentlicht: 13. Februar 2024 ; Gesehen am 29.07.2024},
  journal={Langmuir},
  doi={10.1021/acs.langmuir.3c03759},
}
@article{UBHD-68467575,
  author={Smith, Christopher E. and Xie, Zuoti and Bâldea, Ioan and Frisbie, C. Daniel},
  title={Work function and temperature dependence of electron tunneling through an N-type perylene diimide molecular junction with isocyanide surface linkers},
  year={2018},
  pages={964-975},
  language={eng},
  issn={2040-3372},
  volume={10},
  number={3},
  note={Gesehen am 13.12.2019},
  journal={Nanoscale},
  doi={10.1039/C7NR06461F},
}
@article{UBHD-68405775,
  author={Xie, Zuoti and Bâldea, Ioan and Frisbie, C. Daniel},
  title={Determination of energy-level alignment in molecular tunnel junctions by transport and spectroscopy},
  subtitle={self-consistency for the case of oligophenylene thiols and dithiols on Ag, Au, and Pt electrodes},
  year={2019},
  pages={3670-3681},
  language={eng},
  issn={1520-5126},
  volume={141},
  number={8},
  note={Gesehen am 08.07.2019},
  journal={Journal of the American Chemical Society},
  doi={10.1021/jacs.8b13370},
}
@article{UBHD-68319607,
  author={Xie, Zuoti and Bâldea, Ioan},
  title={Effect of heteroatom substitution on transport in alkanedithiol-based molecular tunnel junctions},
  subtitle={evidence for universal behavior},
  year={2017},
  pages={569-578},
  language={eng},
  issn={1936-086X},
  volume={11},
  number={1},
  note={Publication Date: December 9, 2016 ; Gesehen am 22.10.2018},
  journal={ACS nano},
  doi={10.1021/acsnano.6b06623},
}
@article{UBHD-68471313,
  author={Xie, Zuoti and Bâldea, Ioan and Frisbie, C. Daniel},
  title={Energy level alignment in molecular tunnel junctions by transport and spectroscopy},
  subtitle={self-consistency for the case of alkyl thiols and dithiols on Ag, Au, and Pt electrodes},
  year={2019},
  pages={18182-18192},
  language={eng},
  issn={1520-5126},
  volume={141},
  number={45},
  note={Gesehen am 07.01.2020},
  journal={Journal of the American Chemical Society},
  doi={10.1021/jacs.9b08905},
}
@article{UBHD-68319598,
  author={Xie, Zuoti and Bâldea, Ioan},
  title={Exceptionally small statistical variations in the transport properties of metal-molecule-metal junctions composed of 80 oligophenylene dithiol molecules},
  year={2017},
  pages={5696-5699},
  language={eng},
  issn={1520-5126},
  volume={139},
  number={16},
  note={Gesehen am 22.10.2018 ; Publication Date: April 10, 2017},
  journal={Journal of the American Chemical Society},
  doi={10.1021/jacs.7b01918},
}
@article{UBHD-68594324,
  author={Xie, Zuoti and Bâldea, Ioan and Smith, Christopher E. and Wu, Yanfei and Frisbie, C. Daniel},
  title={Experimental and theoretical analysis of Nnanotransport in oligophenylene dithiol junctions as a function of molecular length and contact work function},
  year={2015},
  pages={8022-8036},
  language={eng},
  issn={1936-086X},
  volume={9},
  number={8},
  note={Gesehen am 30.06.2020},
  journal={ACS nano},
  doi={10.1021/acsnano.5b01629},
}
@article{UBHD-68389963,
  author={Xie, Zuoti and Bâldea, Ioan},
  title={Mechanical deformation distinguishes tunneling pathways in molecular junctions},
  year={2019},
  pages={497-504},
  language={eng},
  issn={1520-5126},
  volume={141},
  number={1},
  note={Published: December 8, 2018 ; Gesehen am 15.05.2019},
  journal={Journal of the American Chemical Society},
  doi={10.1021/jacs.8b11248},
}
@article{UBHD-68803112,
  author={Xie, Zuoti and Bâldea, Ioan and Nguyen, Quyen Van and Frisbie, C. Daniel},
  title={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},
  year={2021},
  pages={16755-16768},
  language={eng},
  issn={2040-3372},
  volume={13},
  number={39},
  note={Gesehen am 18.11.2021},
  journal={Nanoscale},
  doi={10.1039/D1NR04410A},
}
@article{UBHD-68565029,
  author={Xie, Zuoti and Bâldea, Ioan and Frisbie, C. Daniel},
  title={Why one can expect large rectification in molecular junctions based on alkane monothiols and why rectification is so modest},
  year={2018},
  pages={4456-4467},
  language={eng},
  issn={2041-6539},
  volume={9},
  number={19},
  note={Gesehen am 16.04.2020},
  journal={Chemical science},
  doi={10.1039/C8SC00938D},
}