X-ray laboratory
Institute of Crystallography Russian Academy of Sciences


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laboratory staff


   The X-ray laboratory was established by Academician Professor N.V.Belov in 1943. At present the main scientific trend of the laboratory relates to establishing correlations between crystal structure and physical properties of crystalline materials. The methods of precision X-ray diffraction studies are being successfully used in the laboratory for determination of the crystal structure of single crystals of various origin - from minerals to biologically active small molecules. Temperature studies and investigations under pressure give grounds for understanding phase transition mechanism at the atomic level. Structural studies of modulated phases are being carrying out intensively as well. The studies of the anomalous behaviour in the thermal vibrations of atoms provide important information on the changes in the chemical bonding in the crystal in the course of the second-order phase transition. The main scientific results of the last period deal with following research trends:
  • X-ray structure studies of the Tl and Y-high-temperature superconductors below and above the superconducting phase transition.
  • The precision structural investigations of Na1+ and Li1+ solid electrolytes in their superionic phase transition.
  • Studies of non-linear optical crystals materials on the basis of KTiOPO4 solid solutions family. Establishing the ways for controlled modification of their non-linear, superionic, and ferroelectric properties by means of isomorphous replacements.
  • Studies of (M2+1-xR3+x)F2+x solid solutions including their clusters structure and analysis of strictural grounds for their high ionic F1- conductivity.
  • Precision structural studies of the crystals possessing special physical properties - such as La3Ga5SiO14, (Ba,Sr)Nb2O2, LiNbO3: Zn, K(H,D)PO4 and others.
   Three Doctors of Sciences, nine Candidates of Sciences, a staff of skilled engineers-designers are currently working at the laboratory. The laboratory is equipped with four 4-circle single crystal diffractometers (temperature up to 10K) and photographic X-ray apparatus for intensity recording.

Several publications which reflect the main scientific trends of the Laboratory:
  • 1). Superconducting Single Crystals of Tl2Ba2CaCu2O8 and YBa2Cu4O8: Crystal Structures in the Vicinity of Tc. V.N.Molchanov, V.I.Simonov Acta Crystallographica, A54, p.6, N.1, 905-913, 1998.
  • 2). Structural Study of TlTiOPO4 Single Crystals at 11K. M.K.Blomberg, M.J.Merisalo, N.I.Sorokina, D.Yu Lee, I.A.Verin, V.I.Voronkova, V.K.Yanovskii, V.I.Simonov Crystallography Reports, 43, N.5, 748-757, 1998. (Translated from Kristallografiya, 43, N.5, 801-811, 1998).
  • 3). Composite Crystal Structure of Modulated Twinned High-Pressure Mg2Sn1.1 Phase. N.B.Bolotina, V.Petricek, V.I.Simonov, T.I.Dyuzheva, N.A.Bendeliani Crystallography Reports, 42, N.6, 896-905, 1997. (Translated from Kristallografiya, 42, N.6, 972-981, 1997).
  • 4). Crystal Structure of Ba0.39Sr0.61Nb2O6 Single Crystals. T.S.Chernaya, B.A.Maksimov, I.A.Verin, L.I.Ivleva, V.I.Simonov Crystallography Reports, 42, N.3, 375-380, 1997. (Translated from Kristallografiya, 42, N.3, 421-426, 1997).
  • 5). Structural Studies of CaF2 (at 296K) and Ca1-xPrxF2+x (at 296 and 170K) Crystals with x=0.1: The Changes in the Fluorite Anionic Motif in the Partial Substitution of Ca2+ by Pr3+ Cations. E.A.Zhurova, B.A.Maksimov, V.I.Simonov, B.P.Sobolev Crystallography Reports, 41, N.3, 413-418, 1996. (Translated from Kristallografiya, 41, N.3, 438-443, 1996).



Structures of TlNbWO6 and RbNbWO6. The frameworks of the structures built of (Nb,W)-octahedra are alike. The only difference is just in the distribution of Tl and Rb-ions in the similar cavities of the structures. The Rb atom lies in the centre of the cavities, while the Tl atom statistically occupies 8 positions with the degree of filling equal 1/8. Such a difference causes Tl-superionic conductivity in TlNbWO6 crystals at 570K sigma=3.10-3(om.cm-1), which is 1-2 order higher than in Rb-compound.


Crystal structure of (La1-xSrx)2CuO4, single crystals which possess high temperature superionic conductivity. It was demonstrated for the first time that the increasing of the amount of Sr in the crystals is accompanied by the ordering of the Sr-atoms over the La-positions starting from the proportional ordering in (La0.97Sr0.03)2CuO4 via the partial one in (La0.94Sr0.06)(La0.86Sr0.14)СuO4 to the complete ordering in La(La0.79Sr0.24)CuO3.92. Such an ordering causes the concentration of Sr2+ in the definite layers of the structure with the simultaneous loss of some oxygen atoms in these layers, which proves to be the reason of decreasing the temperature of HTc phase transition in the corresponding crystal samples.

Professor V.I.Simonov
Institute of Crystallography RAS, 59 Leninsky pr., Moscow 117333, Russia.
phone:  +7(095)1352010,
fax:  +7(095)1355210,
е-mail:  simonov@ns.crys.ras.ru








Addresses and Phones


namepositionphone,+7-495-e-mail
Rabadanov M.Kh.head of lab.135-5210rab_mur@ns.crys.ras.ru
Simonov V.I.lead res.135-2010simonov@ns.crys.ras.ru
Pusharovskii D.Yu.lead res.135-5210-
Rastsvetaeva R.K.lead res.135-3400rast@ns.crys.ras.ru
Furmanova N.G.lead res.135-3110furm@ns.crys.ras.ru
Abramova T.S.engineer135-2010-
Alekseeva O.A.researcher135-3110olalex@ns.crys.ras.ru
Belova E.N.senior res.--
Bolotina N.B.lead res.135-3110bolotina@ns.crys.ras.ru
Verin I.A.main spec.135-0330krol@ns.crys.ras.ru
Vigdorchik A.G.senior res.135-3110asyavig@ns.crys.ras.ru
Gavrikov S.I.engineer--
Grogoreva N.B.researcher135-3110natgrig@ns.crys.ras.ru
Dudka A.P.senior res.135-3110dudka@ns.crys.ras.ru
Eremina T.A.researcher135-0400terem@ns.crys.ras.ru
Jovner M.S.engineer--
Ivanova A.G.researcher135-3400-
Kazantsev S.S.researcher135-3400kazantsev1@yandex.ru
Klimenkova A.A.engineer--
Malakhova L.F.senior res.135-3110malakhova@ns.crys.ras.ru
Mironov V.S.lead res.135-3110-
Molchanov V.N.lead res.135-0330vladimol@ns.crys.ras.ru
Novikova N.E.researcher135-3110natnov@ns.crys.ras.ru
Rozenberg K.A.researcher135-3400-
Sorokina N.I.lead res.135-3110nsor@ns.crys.ras.ru
Sulyanova E.A.researcher135-3400-
Filaretov A.A.researcher135-0330-
Chernaya T.S.senior res.135-3400chert@ns.crys.ras.ru



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