Publications

@article{SciRep13-14571,

title = {Vibrational-mechanical properties of the highly-mismatched Cd$_1-x$Be$_x$Te semiconductor alloy: experiment and ab initio calculations},

author = {A. Elmahjoubi and M. B. Shoker and O. Pagès and V. J. B. Torres and A. Polian and A. V. Postnikov and C. Bellin and K. Béneut and C. Gardiennet and G. Kervern and A. En Naciri and L. Broch and R. Hajj Hussein and J. -P. Itié and L. Nataf and S. Ravy and P. Franchetti and S. Diliberto and S. Michel and A. Abouais and K. Strzałkowski},

url = {https://doi.org/10.1038/s41598-023-39248-6},

doi = {10.1038/s41598-023-39248-6},

year  = {2023},

date = {2023-09-01},

journal = {Scientific Reports},

volume = {12},

pages = {14571},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JPhysChemC127-11787,

title = {First-Principles Study of Hydrogen Dynamics in Monoclinic TiO},

author = {S. Vahid Hosseini and Andrei Postnikov and Mohammad Reza Mohammadizadeh},

url = {https://doi.org/10.1021/acs.jpcc.3c00750},

doi = {10.1021/acs.jpcc.3c00750},

year  = {2023},

date = {2023-06-01},

journal = {The Journal of Physical Chemistry C},

volume = {127},

number = {25},

pages = {11787–11800},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JAP133-065701,

title = {Raman study of Cd$_1-x$1Zn$_x$Te phonons and phonon-polaritons – Experiment and ab initio calculations},

author = {T. Alhaddad and M. B. Shoker and O. Pagès and A. V. Postnikov and V. J. B. Torres and A. Polian and Y. Le Godec and J. P. Itié and L. Broch and M. B. Bouzourâa and A. En Naciri and S. Diliberto and S. Michel and P. Franchetti and A. Marasek and K. Strzałkowski},

url = {https://doi.org/10.1063/5.0134454},

doi = {10.1063/5.0134454},

year  = {2023},

date = {2023-01-01},

journal = {Journal of Applied Physics},

volume = {133},

number = {6},

pages = {065701},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PCCP25-26461,

title = {Potential of nanostructured carbon materials for iodine detection in realistic environments revealed by first-principles calculations},

author = {Kazem Zhour and Ayoub Daouli and Andrei Postnikov and Abdellatif Hasnaoui and Michael Badawi},

url = {http://dx.doi.org/10.1039/D3CP02205F},

doi = {10.1039/D3CP02205F},

year  = {2023},

date = {2023-01-01},

journal = {Phys. Chem. Chem. Phys.},

volume = {25},

issue = {39},

pages = {26461-26474},

publisher = {The Royal Society of Chemistry},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{SciRep12-753,

title = {Exceptional phonon point versus free phonon coupling in Zn$_1-x$Be$_x$Te under pressure: an experimental and ab initio Raman study},

author = {M. B. Shoker and T. Alhaddad and O. Pagès and V. J. B. Torres and A. V. Postnikov and A. Polian and R. Hajj Hussein and G. K. Pradhan and C. Narayana and C. Gardiennet and G. Kervern and L. Nataf and S. Ravy and J. -P. Itié and K. Strzałkowski and A. Marasek and F. Firszt},

url = {https://doi.org/10.1038/s41598-022-04815-w},

doi = {10.1038/s41598-022-04815-w},

year  = {2022},

date = {2022-01-01},

journal = {Scientific Reports},

volume = {12},

pages = {753},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{SurfIn25-101264,

title = {First-principles investigation of CO$_2$, CO, and O$_2$ adsorptions on the (001)-reconstructed surfaces of CsPbX$_3$ (X = Cl, Br, and I) perovskites},

author = {Arpit Mishra and Philippe Baranek and Andrei Postnikov},

url = {https://doi.org/10.1016/j.surfin.2021.101264},

doi = {10.1016/j.surfin.2021.101264},

year  = {2021},

date = {2021-08-01},

journal = {Surfaces and Interfaces},

volume = {15},

pages = {101264},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PSSB258-2100131,

title = {Theoretical Mapping of Interaction between Alkali Metal Atoms Adsorbed on Graphene-Like BC$_3$ Monolayer},

author = {Kazem Zhour and Andrei Postnikov},

url = {https://doi.org/10.1002/pssb.202100131},

doi = {10.1002/pssb.202100131},

year  = {2021},

date = {2021-08-01},

journal = {physica status solidi (b)},

volume = {258},

number = {8},

pages = {2100131},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{SoftComput_2021,

title = {Quantum simulation of the ground-state Stark effect in small molecules: a case study using IBM Q},

author = {Carlos Tavares and Sofia Oliveira and Vitor Fernandes and Andrei Postnikov and Mikhail I. Vasilevskiy},

url = {https://doi.org/10.1007/s00500-020-05492-5},

doi = {10.1007/s00500-020-05492-5},

year  = {2021},

date = {2021-01-01},

journal = {Soft Computing},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JPhysChemC124-10353,

title = {Effects of Copper Substitution by Alkali Metals on the Properties of Chalcopyrites for Tandem Applications: Insights from Theory},

author = {Fabien Lafond and Philippe Baranek and Andrei Postnikov},

url = {https://doi.org/10.1021/acs.jpcc.0c01767},

doi = {10.1021/acs.jpcc.0c01767},

year  = {2020},

date = {2020-05-01},

journal = {The Journal of Physical Chemistry C},

volume = {124},

number = {19},

pages = {10353},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JChemPhys152-204108,

title = {Siesta: Recent developments and applications},

author = {Alberto Garc'ıa and Nick Papior and Arsalan Akhtar and Emilio Artacho and Volker Blum and Emanuele Bosoni and Pedro Brandimarte and Mads Brandbyge and J. I. Cerdá and Fabiano Corsetti and Ramón Cuadrado and Vladimir Dikan and Jaime Ferrer and Julian Gale and Pablo Garc'ıa-Fernández and V. M. Garcíıa-Suárez and Sandra Garc'ı and Georg Huhs and Sergio Illera and Richard Korytár and Peter Koval and Irina Lebedeva and Lin Lin and Pablo López-Tarifa and Sara G. Mayo and Stephan Mohr and Pablo Ordejón and Andrei Postnikov and Yann Pouillon and Miguel Pruneda and Roberto Robles and Daniel Sánchez-Portal and Jose M. Soler and Rafi Ullah and Victor Wen-zhe Yu and Javier Junquera},

url = {https://doi.org/10.1063/5.0005077},

doi = {10.1063/5.0005077},

year  = {2020},

date = {2020-05-01},

journal = {The Journal of Chemical Physics},

volume = {152},

number = {20},

pages = {204108},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Semicon54-1,

title = {Effect of Oxygen and Fluorine Absorption on the Electronic Structure of the InSb(111) Surface},

author = {A. A. Fuks and A. V. Bakulin and S. E. Kulkova and N. A. Valisheva and A. V. Postnikov},

url = {https://doi.org/10.1134/S106378262001008X},

doi = {10.1134/S106378262001008X},

year  = {2020},

date = {2020-03-01},

journal = {Semiconductors},

volume = {54},

number = {1},

pages = {1},

note = {(Russian text: Fizika i Tekhnika Poluprovodnikov, 2020, Vol. 54, No. 1, pp. 3-12)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JAP126-105707,

title = {Multi-phonon (percolation) behavior and local clustering of Cd$_x$Zn$_1-x$Se-cubic mixed crystals ($xłeq0.3$): A Raman-emphab initio study},

author = {M. B. Shoker and O. Pagès and H. Dicko and V. J. B. Torres and A. V. Postnikov and A. Polian and F. Firszt and K. Strzałkowski and A. En Naciri and L. Broch and M. N. Rao and R. Rao and A. Maillard and J. -P. Itié},

url = {https://doi.org/10.1063/1.5111106},

doi = {10.1063/1.5111106},

year  = {2019},

date = {2019-09-01},

journal = {Journal of Applied Physics},

volume = {126},

number = {10},

pages = {105707},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{SciRep9-7817,

title = {Defect-induced ultimately fast volume phonon-polaritons in the wurtzite Zn$_0.74$Mg$_0.26$Se mixed crystal},

author = {H. Dicko and O. Pagès and M. B. Shoker and F. Firszt and K. Strzałkowski and A. Maillard and A. Polian and Y. Battie and L. Broch and A. En Naciri and A. V. Postnikov and W. Paszkowicz and J. -P. Itié},

url = {https://www.nature.com/articles/s41598-019-44273-5},

doi = {10.1038/s41598-019-44273-5},

year  = {2019},

date = {2019-05-01},

journal = {Scientific Reports},

volume = {9},

pages = {7817},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JChemPhys149-054106,

title = {Comparative study of structural and electronic properties of GaSe and InSe polytypes},

author = {Juliana Srour and Michael Badawi and Fouad El Haj Hassan and Andrei Postnikov},

url = {https://doi.org/10.1063/1.5030539},

doi = {10.1063/1.5030539},

year  = {2018},

date = {2018-08-01},

journal = {The Journal of Chemical Physics},

volume = {149},

number = {5},

pages = {054106},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Nanotechnology29-285704,

title = {Suggested design of gold-nanoobjects-based terahertz radiation source for biomedical research},

author = {A. V. Postnikov and K. A. Moldosanov},

url = {http://stacks.iop.org/0957-4484/29/i=28/a=285704},

year  = {2018},

date = {2018-07-01},

journal = {Nanotechnology},

volume = {29},

number = {28},

pages = {285704},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JAP122-035707,

title = {Calculation of point defect concentration in Cu$_2$ZnSnS$_4$: Insights into the high-temperature equilibrium and quenching},

author = {V. Kosyak and A. V. Postnikov and J. Scragg and M. A. Scarpulla and C. Platzer-Björkman},

url = {http://dx.doi.org/10.1063/1.4994689},

doi = {10.1063/1.4994689},

year  = {2017},

date = {2017-07-01},

journal = {Journal of Applied Physics},

volume = {122},

number = {3},

pages = {035707},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PSSB254-1700120,

title = {Competing structures in (In,Ga)Se and (In,Ga)$_2$Se$_3$ semiconductors},

author = {J. Srour and A. Postnikov and M. Badawi and F. El Haj Hassan},

url = {http://dx.doi.org/10.1002/pssb.201700120},

doi = {10.1002/pssb.201700120},

issn = {1521-3951},

year  = {2017},

date = {2017-06-01},

journal = {physica status solidi (b)},

volume = {254},

number = {6},

pages = {1700120},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Ferroel509-158,

title = {Terahertz imaging technique for cancer diagnostics using frequency conversion by gold nano-objects},

author = {K. A. Moldosanov and A. V. Postnikov and V. M. Lelevkin and N. J. Kairyev},

url = {http://dx.doi.org/10.1080/00150193.2017.1296344},

doi = {10.1080/00150193.2017.1296344},

year  = {2017},

date = {2017-01-01},

journal = {Ferroelectrics},

volume = {509},

number = {1},

pages = {158},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PSSB253-1472,

title = {Crystal structure and energy bands of (Ga/In)Se and Cu(In,Ga)Se$_2$ semiconductors in comparison},

author = {J. Srour and M. Badawi and F. El Haj Hassan and A. V. Postnikov},

url = {http://dx.doi.org/10.1002/pssb.201552776},

doi = {10.1002/pssb.201552776},

issn = {1521-3951},

year  = {2016},

date = {2016-08-01},

journal = {physica status solidi (b)},

volume = {253},

number = {8},

pages = {1472–1475},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JPCM28-205401,

title = {Pressure-induced phonon freezing in the ZnSeS II-VI mixed crystal: phonon-polaritons and ab initio calculations},

author = {R. Hajj Hussein and O. Pagès and A. Polian and A. Postnikov and H. Dicko and F. Firszt and K. Strzałkowski and W. Paszkowicz and L. Broch and S. Ravy and P. Fertey},

url = {http://dx.doi.org/10.1088/0953-8984/28/20/205401},

doi = {DOI: 10.1088/0953-8984/28/20/205401},

year  = {2016},

date = {2016-05-01},

journal = {J.~Phys.: Condens. Matter},

volume = {28},

number = {20},

pages = {205401 (13~pp)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{CurrApplPhys16-288,

title = {Ab initio predictions of structure preferences and band gap character in ordered AlAs$_1-x$Bi$_x$ alloys},

author = {R. Alaya and M. Mbarki and A. Rebey and A. V. Postnikov},

url = {http://dx.doi.org/10.1016/j.cap.2015.11.019},

doi = {http://dx.doi.org/10.1016/j.cap.2015.11.019},

year  = {2016},

date = {2016-03-01},

journal = {Current Applied Physics},

volume = {16},

issue = {3},

pages = {288 – 293},

publisher = {Elsevier},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{BeilJNano7-983,

title = {A terahertz-vibration to terahertz-radiation converter based on gold nanoobjects: a feasibility study},

author = {Kamil Moldosanov and Andrei Postnikov},

doi = {10.3762/bjnano.7.90},

issn = {2190-4286},

year  = {2016},

date = {2016-01-01},

journal = {Beilstein Journal of Nanotechnology},

volume = {7},

pages = {983},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JAlCom644-704,

title = {Percolation-type multi-phonon pattern of Zn(Se,S): Backward/forward Raman scattering and textitab initio calculations},

author = {R. Hajj Hussein and O. Pagès and S. Doyen-Schuler and H. Dicko and A. V. Postnikov and F. Firszt and A. Marasek and W. Paszkowicz and A. Maillard and L. Broch and O. Gorochov},

url = {http://dx.doi.org/10.1016/j.jallcom.2015.04.078},

doi = {10.1016/j.jallcom.2015.04.078},

year  = {2015},

date = {2015-09-01},

journal = {Journal of Alloys and Compounds},

volume = {644},

pages = {704},

publisher = {Elsevier},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB92-054431,

title = {Transmission through correlated Cu$_n$CoCu$_n$ heterostructures},

author = {L. Chioncel and C. Morari and A. Östlin and W. H. Appelt and A. Droghetti and M. M. Radonjić and I. Rungger and L. Vitos and U. Eckern and A. V. Postnikov},

url = {http://link.aps.org/doi/10.1103/PhysRevB.92.054431},

doi = {10.1103/PhysRevB.92.054431},

year  = {2015},

date = {2015-08-01},

journal = {Phys. Rev. B},

volume = {92},

issue = {5},

pages = {054431},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Shimla2014,

title = {Ab initio lattice dynamics of mixed semiconductors},

author = {Andrei Postnikov},

url = {http://dx.doi.org/10.1063/1.4915358},

doi = {10.1063/1.4915358},

year  = {2015},

date = {2015-05-01},

journal = {AIP Conf. Proc.},

volume = {1661},

pages = {030003},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB89-155201,

title = {Lattice dynamics of the model percolation-type (Zn,Be)Se alloy: Inelastic neutron scattering, textitab initio study, and shell-model calculations},

author = {Mala N. Rao and D. Lamago and A. Ivanov and M. d'Astuto and A. V. Postnikov and R. Hajj Hussein and Tista Basak and S. L. Chaplot and F. Firszt and W. Paszkowicz and S. K. Deb and O. Pagès},

url = {http://link.aps.org/doi/10.1103/PhysRevB.89.155201},

doi = {10.1103/PhysRevB.89.155201},

year  = {2014},

date = {2014-04-01},

journal = {Phys. Rev. B},

volume = {89},

issue = {15},

pages = {155201},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JAP114-124501,

title = {Model of native point defect equilibrium in Cu$_2$ZnSnS$_4$ and application to one-zone annealing},

author = {V. Kosyak and N. B. Mortazavi Amiri and A. V. Postnikov and M. A. Scarpulla},

url = {http://dx.doi.org/10.1063/1.4819206},

doi = {10.1063/1.4819206},

year  = {2013},

date = {2013-09-01},

journal = {J. Appl. Physics},

volume = {114},

issue = {12},

pages = {124501},

publisher = {AIP Publishing LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Fe30-Dalton,

title = {Electronic structure and soft-X-ray-induced photoreduction studies of iron-based magnetic polyoxometalates of type (M)M$_5$$_12$Fe$^rm III_30$ (M = Mo$^rm VI$, W$^rm VI$)},

author = {Karsten Kuepper and Christine Derks and Christian Taubitz and Manuel Prinz and Lo"ıc Joly and Jean-Paul Kappler and Andrei Postnikov and Wanli Yang and Tatyana V. Kuznetsova and Ulf Wiedwald and Paul Ziemann and Manfred Neumann},

url = {http://dx.doi.org/10.1039/C3DT32759K},

doi = {10.1039/C3DT32759K},

year  = {2013},

date = {2013-01-01},

journal = {Dalton Transactions},

volume = {42},

pages = {7924-7935},

publisher = {The Royal Society of Chemistry},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PSSA210-1332,

title = {Calculated vibration spectrum of monoclinic Cu$_2$SnSe$_3$ in comparison with kesterite-type Cu$_2$ZnSnSe$_4$},

author = {Andrei Postnikov and Narjes B. Mortazavi Amiri},

url = {http://dx.doi.org/10.1002/pssa.201200837},

doi = {10.1002/pssa.201200837},

year  = {2013},

date = {2013-01-01},

journal = {Phys.Status Solidi A},

volume = {210},

issue = {7},

pages = {1332-1335},

publisher = {Wiley-VCH},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Ferroel438-45,

title = {Electronic Structure of Rare-Earth Scandates from X-Ray Spectroscopy and First-Principles Calculations},

author = {A. V. Postnikov and C. Derks and K. Kuepper and M. Neumann},

url = {http://link.aps.org/doi/10.1080/00150193.2012.743833},

doi = {10.1080/00150193.2012.743833},

year  = {2012},

date = {2012-12-01},

journal = {Ferroelectrics},

volume = {438},

issue = {1},

pages = {45–54},

publisher = {Taylor & Francis},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{InCh51-10929,

title = {Environmental Influence on the Single-Molecule Magnet Behavior of [Mn$^III_6$Cr$^III$]$^3+$: Molecular Symmetry versus Solid-State Effects},

author = {Veronika Hoeke and Maik Heidemeier and Erich Krickemeyer and Anja Stammler and Hartmut Bögge and Jürgen Schnack and Andrei Postnikov and Thorsten Glaser},

url = {dx.doi.org/10.1021/ic301406j},

doi = {10.1021/ic301406j},

year  = {2012},

date = {2012-10-01},

journal = {Inorg.~Chem.},

volume = {51},

issue = {20},

pages = {10929–10954},

publisher = {American Chemical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB86-155124,

title = {Band-gap variation in $R$ScO$_3$ ($R$=Pr, Nd, Sm, Eu, Gd, Tb, and Dy): X-ray absorption and O$K$-edge x-ray emission spectroscopies},

author = {C. Derks and K. Kuepper and M. Raekers and A. V. Postnikov and R. Uecker and W. L. Yang and M. Neumann},

url = {http://link.aps.org/doi/10.1103/PhysRevB.86.155124},

doi = {10.1103/PhysRevB.86.155124},

year  = {2012},

date = {2012-10-01},

journal = {Phys.~Rev.~B},

volume = {86},

issue = {15},

pages = {155124},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JNP6-061709,

title = {Non-plasmonic hyperthermia: prerequisites for realization and materials},

author = {Andrei V. Postnikov and Kamil A. Moldosanov},

url = {http://link.aps.org/doi/10.1117/1.JNP.6.061709},

doi = {10.1117/1.JNP.6.061709},

year  = {2012},

date = {2012-10-01},

journal = {Journal of Nanophotonics},

volume = {6},

issue = {1},

pages = {061709},

publisher = {SPIE},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JAP112-033719,

title = {Secondary phase Cu$_2$SnSe$_3$ vs. kesterite Cu$_2$ZnSnSe$_4$: Similarities and differences in lattice vibration modes},

author = {Narjes Beigom Mortazavi Amiri and Andrei Postnikov},

url = {http://link.aip.org/link/?JAP/112/033719},

doi = {10.1063/1.4745894},

year  = {2012},

date = {2012-08-01},

journal = {J. Appl. Phys.},

volume = {112},

issue = {3},

pages = {033719},

publisher = {American Institute of Physics},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB86-045201,

title = {Re-examination of the SiGe Raman spectra: Percolation/one-dimensional-cluster scheme and textitab initio calculations},

author = {O. Pagès and J. Souhabi and V. J. B. Torres and A. V. Postnikov and K. C. Rustagi},

url = {http://link.aps.org/doi/10.1103/PhysRevB.86.045201},

doi = {10.1103/PhysRevB.86.045201},

year  = {2012},

date = {2012-07-01},

journal = {Phys.~Rev.~B},

volume = {86},

issue = {4},

pages = {045201},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JJAP50-05FE02,

title = {The Phonon Percolation Scheme for Alloys: Extension to the Entire Lattice Dynamics and Pressure Dependence},

author = {Gopal Krushna Pradhan and Chandrabhas Narayana and Mala Narasappaya Rao and Matteo DÁstuto and Samrath Lal Chaplot and Olivier Pagès and A. Breidi and Jihane Souhabi and Andrei Postnikov and Sudip Kumar Deb and Tapas Ganguli and Alain Polian and Gopalkrishna Bhalerao and Abhay Shukla and Franciszek Firszt and Wojciech Paszkowicz},

url = {http://jjap.jsap.jp/link?JJAP/50/05FE02/},

doi = {10.1143/JJAP.50.05FE02},

year  = {2011},

date = {2011-05-01},

journal = {Japanese Journal of Applied Physics},

volume = {50},

number = {5},

pages = {05FE02},

publisher = {The Japan Society of Applied Physics},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JJAP50-05FE04,

title = {emphAb initio Phonons in Kesterite and Stannite-Type Cu$_2$ZnSnSe$_4$},

author = {Andrei Postnikov and Narjes Beigom Mortazavi Amiri},

url = {http://jjap.jsap.jp/link?JJAP/50/05FE04/},

doi = {10.1143/JJAP.50.05FE04},

year  = {2011},

date = {2011-05-01},

journal = {Japanese Journal of Applied Physics},

volume = {50},

number = {5},

pages = {05FE04},

publisher = {The Japan Society of Applied Physics},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB82-205204,

title = {Electronic structure and lattice dynamics in kesterite-type Cu$_2$ZnSnSe$_4$ from first-principles calculations},

author = {Narjes Beigom Mortazavi Amiri and Andrei Postnikov},

url = {http://link.aps.org/doi/10.1103/PhysRevB.82.205204},

doi = {10.1103/PhysRevB.82.205204},

year  = {2010},

date = {2010-11-01},

journal = {Phys.~Rev.~B},

volume = {82},

number = {20},

pages = {205204},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{JAC-quaternary,

title = {Structural, electronic, optical and thermal properties of Al$_x$Ga$_1-x$As$_y$Sb$_1-y$ quaternary alloys: First-principlesstudy},

author = {F. El Haj Hassan and A. V. Postnikov and O. Pagès},

doi = {10.1016/j.jallcom.2010.05.161},

year  = {2010},

date = {2010-08-01},

journal = {Journal of Alloys and Compounds},

volume = {504},

number = {2},

pages = {559–565},

publisher = {Elsevier},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB82-054418,

title = {Magnetic properties of small Pt-capped Fe, Co, and Ni clusters: A density functional theory study},

author = {Sanjubala Sahoo and Alfred Hucht and Markus E. Gruner and Georg Rollmann and Peter Entel and Andrei Postnikov and Jaime Ferrer and Lucas Fernández-Seivane and Manuel Richter and Daniel Fritsch and Shreekantha Sil},

doi = {10.1103/PhysRevB.82.054418},

year  = {2010},

date = {2010-08-01},

journal = {Phys.~Rev.~B},

volume = {82},

number = {5},

pages = {054418},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB81-205213,

title = {Cinnabar and SC16 high-pressure phases of ZnSe: An ab initio study},

author = {A. Breidi and A. V. Postnikov and F. El Haj Hassan},

doi = {10.1103/PhysRevB.81.205213},

year  = {2010},

date = {2010-05-01},

journal = {Phys.~Rev.~B},

volume = {81},

number = {20},

pages = {205213},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Mn3Cr-star,

title = {A Star-Shaped Heteronuclear Cr$^rmIII$Mn$^rmII_3$ Species and Its Precise Electronic and Magnetic Structure: Spin Frustration Studied by X-Ray Spectroscopic, Magnetic, and Theoretical Methods},

author = {Manuel Prinz and Karsten Kuepper and Christian Taubitz and Michael Raekers and Sumit Khanra and Biplab Biswas and Thomas Weyhermüller and Marc Uhlarz and Joachim Wosnitza and Jürgen Schnack and Andrei V. Postnikov and Christian Schröder and Simon J. George and Manfred Neumann and Phalguni Chaudhuri},

doi = {10.1021/ic901219},

year  = {2010},

date = {2010-03-01},

journal = {Inorg.~Chem.},

volume = {49},

number = {5},

pages = {2093–2102},

publisher = {American Chemical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB81-115207,

title = {Pressure-induced phonon freezing in the Zn$_1-x$Be$_x$Se alloy: A study via the percolation model},

author = {Gopal K. Pradhan and Chandrabhas Narayana and O. Pagès and A. Breidi and J. Souhabi and A. V. Postnikov and S. K. Deb and F. Firszt and W. Paszkowicz and A. Shukla and Fouad El Haj Hassan},

url = {http://link.aps.org/doi/10.1103/PhysRevB.81.115207},

doi = {10.1103/PhysRevB.81.115207},

year  = {2010},

date = {2010-03-01},

journal = {Phys.~Rev.~B},

volume = {81},

number = {11},

pages = {115207},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{EPJB73-461,

title = {Non-random Be-to-Zn substitution in ZnBeSe alloys: Raman scattering and ab initio calculations},

author = {O. Pagès and A. V. Postnikov and A. Chafi and D. Bormann and P. Simon and F. Glas and F. Firszt and W. Paszkowicz and E. Tournié},

url = {http://dx.doi.org/10.1140/epjb/e2010-00047-0},

doi = {10.1140/epjb/e2010-00047-0},

year  = {2010},

date = {2010-02-01},

journal = {Eur.~Phys.~J.~B},

volume = {73},

number = {4},

pages = {461},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{PRB80-220409,

title = {Charge order, enhanced orbital moment, and absence of magnetic frustration in layered multiferroic LuFe$_2$O$_4$},

author = {K. Kuepper and M. Raekers and C. Taubitz and M. Prinz and C. Derks and M. Neumann and A. V. Postnikov and F. M. F. Groot and C. Piamonteze and D. Prabhakaran and S. J. Blundell},

doi = {10.1103/PhysRevB.80.220409},

year  = {2009},

date = {2009-12-01},

journal = {Phys.~Rev.~B},

volume = {80},

number = {22},

pages = {220409},

publisher = {American Physical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}