22.09.2016

Databases of IMET RAS are integrated with information resources of National Institute for Materials Science (NIMS), Japan, Joint Institute for High Temperatures of RAS (JIHT RAS) and M.V.Lomonosov Moscow State University.

Database on the phase diagrams of semiconductor systems "Diagram"
http://diag.imet-db.ru

Database on substances with significant acousto-optical, electro-optical and nonlinear optical properties "Crystal"
http://crystal.imet-db.ru

Database on properties of inorganic compounds "Phases"
http://phases.imet-db.ru

Database on width of forbidden zone of inorganic substances "Bandgap"
http://bg.imet-db.ru

Database on properties of chemical elements "Elements"
http://phases.imet-db.ru/elements

Database of information resources on inorganic chemistry and materials science "IRIC"
http://en.iric.imet-db.ru

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The basic publications of N.N.Kiselyova

Databases

  1. E.M.Savitskii, N.N.Kiselyova , B.N.Pischik, et al. Development of automatized data bank on ternary inorganic compounds’ properties // Dokladi Akad.Nauk SSSR . 1984. V.279, N.3. P.627-629.
  2. M.S.Golikova, G.S.Burkhanov, N.N.Kiselyova, et al. Databank on properties of acousto-optical of inorganic compounds // Izvestiya Akad.Nauk SSSR, Neorganicheskie Materialy . 1989. V.25, N.4. P.700-701.
  3. N.V.Kravchenko, G.S.Burkhanov, N.N.Kiselyova, et al. Databank on properties of crystals for management of a laser radiation // Izvestiya Akad.Nauk SSSR, Neorganicheskie Materialy . 1991. V.27, N.1. P.164-165.
  4. N.N.Kiselyova, N.V.Kravchenko. Database on ternary inorganic compounds’ properties as basis for computer design of new substances // Zh.Neorgan.Khimii. 1992. V.37, N.3. P.698-702.
  5. V.S.Zemskov, N.N.Kiseleva, N.N.Kiselev, et al. DIAGRAMMA database on phase diagrams of semiconducting systems // Inorganic Materials. 1995. V.31, N.9. P.1096-1101.
  6. N.V.Yudina, V.V.Petukhov, E.A. Cheremushkin, et al. Data bank on acoustooptical, electrooptical, and nonlinear optical properties of materials // Crystallography Reports. 1996. V.41, N.2. P.464-470.
  7. N.N.Kiselyova, N.V.Kravchenko, V.V.Petukhov. Database system on the properties of ternary inorganic compounds (IBM PC version)// Inorganic Materials. 1996. V.32, N.5. P.567-570.
  8. V.S.Zemskov, N.N.Kiselyova, V.V.Petukhov, et al. Database on phase diagrams of semiconducting systems // Izvestiya VUZov. Materialy elektron.tekhniki. 1998. №3. P.17-23.
  9. I.N.Belokurova, V.S.Zemskov, N.N.Kiselyova. Statistical analysis of phase diagram data for semiconductor systems // Inorganic Materials. 1998. V.34, №3. P.306-308.
  10. Yu.I.Degtyaryov, V.V.Podbel’skii, N.N.Kiselyova, et al. Database on properties of acousto-optical, electro-optical, and nonlinear-optical properties of crystals with Internet access // Izvestiya VUZov. Materialy elektron.tekhniki. 1999. N.3. P.35-40.
  11. Yu.I.Khristoforov, V.V.Khorbenko, N.N.Kiselyova, et al Database on phase diagrams of semiconducting systems with Internet access // Izvestiya VUZov. Materialy elektron.tekhniki. 2001. №4. P.50-55.
  12. I.N.Belokurova, V.A.Dudarev, V.S.Zemskov et al. Database on materials for electronics with Internet access // Informatsionnoe obshchestvo. 2001. N.5. P.24-27.
  13. N.N.Kiselyova, I.V.Prokoshev, V.A. Dudarev, et al . Internet-accessible electronic materials database system // Inorganic Materials. 2004. V.42, №3. P.380-384.

  14. N.Kiselyova, V.Dudarev, I. Prokoshev , et al. The Distributed System of Databases on Properties of Inorganic Substances and Materials // Int. Journal “Information Theories & Applications”. 2005. V.12, №3. P.219-224.

  15. V.A.Dudarev, N.N.Kiselyova, V.S.Zemskov. Integrated system of databases on properties of materials for electronics // Perspektivnye Materialy. 2006. №5. P.20-25.
  16. N.Kiselyova, D.Murat, A.Stolyarenko, et al. Database on properties of ternary inorganic compounds in Internet // Informatsionnye resursy Rossii. 2006. №4. P .21-23.
  17. Kiselyova N., Iwata S., Dudarev V., Prokoshev I., Khorbenko V., Zemskov V. Integration Principles of Russian and Japanese Databases on Inorganic Materials // Int.J.Information Technologies and Knowledge. 2008. V.2. N.4. P.366-372.

  18. Kiselyova N. N., Dudarev V. A., Zemskov V. S. Computer information resources in inorganic chemistry and materials science // Russian Chemical Reviews. 2010. V.79. N.2. P.145-166.

  19. Kiselyova N.N., Dudarev V. A., Korzhuev M. A. Database on bandgaps of inorganic substances and materials // Inorganic Materials: Applied Research. 2016. V. 7. N. 1. P.34-39.

  20. Kiselyova N. N., Dudarev V. A., Stolyarenko A. V. Integrated system of databases on the properties of inorganic substances and materials // High Temperature. 2016. V. 54. N. 2. P.215-222.
  21. Kiselyova N.N., Dudarev V.A. Creating Inorganic Chemistry Data Infrastructure for Materials Science Specialists // Communications in Computer and Information Science. 2017. V.706. Eds. L. Kalinichenko, Y. Manolopoulos & S.O.Kuznetsov. Cham: Springer International Publ. AG. P. 222-236.

Computer design of inorganic substances and materials

  1. N.N.Kiselyova, E.M.Savitskii . Prediction of inorganic compounds with composition ABO2 using computer learning // Dokladi Akad.Nauk SSSR . 1977. V.235, N.6. P.1367-1370.
  2. N.N.Kiselyova , B.I.Pokrovskii , L.N.Komissarova, N.D.Vashchenko. Application cybernetic concept formation system to predicting formation of multi-component chemical compounds // Zh. Neorgan. Khimii . 1977. V.22, N.4. P.883-886.
  3. E.M.Savitskii, V.P.Gladun, N.N.Kiselyova. Prediction of compounds with composition A2B2O7 with pyrochlore-structure // Dokladi Akad.Nauk SSSR . 1977. V.233, N.4. P.657-660.
  4. E.M.Savitskii, N.N.Kiselyova, N.D.Vashchenko. Application of computer learning to the search for new compounds with composition AB2Te 4 // Dokladi Akad.Nauk SSSR . 1978. V.239, N.5. P.1154-1156.
  5. E.M.Savitskii, N.N.Kiselyova. Prediction of superconducting Chevrel phases // Dokladi Akad. Nauk SSSR. 1978. V.239, N.2. P.405-407.
  6. E.M.Savitskii, N.N.Kiselyova. Cybernetic prediction of formation of phases with composition ABX 2 // Izvestiya Akad.Nauk SSSR, Neorganicheskie Materialy . 1979. V.15, N.6. P.1101-1102.
  7. N.N.Kiselyova , E.M.Savitskii . Prediction of chalco-spinels with composition AB2X4 using computer learning method // Zh. Neorgan. Khimii . 1979. V.24, N.6. P.1427-1429.
  8. E.M.Savitskii, V.B.Gribulya, and N.N.Kiselyova. Cybernetic prediction of superconducting compounds // CALPHAD. 1979. V.3, №3. P.171-173.

  9. E.M.Savitskii, V.B.Gribulya, and N.N.Kiselyova. On the application of cybernetic prediction systems to the search for new magnetic materials // J. Less-Common Metals. 1980. V.72. P.307-315.

  10. E.M.Savitskii, V.B.Gribulya, and N.N.Kiseleva. Forecasting of superconducting compounds // Phys. stat. sol. (a). 1981. V.63. P.K67-K72.
  11. N.N.Kiselyova, E.M.Savitskii . Cybernetic prediction of Chevrel phases with selenium // Zh. Neorgan. Khimii . 1981. V.26, N.5. P.1364-1367.
  12. N.N.Kiselyova , E.M.Savitskii . Prediction of compounds with composition ABHal4 in systems of halides // Zh. Neorgan. Khimii . 1982. V.27, N.11. P.2880-2884.
  13. E.M.Savitskii, N.N.Kiselyova , V.M.Shkatova. Cybernetic-statistical approach to the search for substances with predefined properties // Izvestiya Akad.Nauk SSSR, Neorganicheskie Materialy . 1982. V.18, N.2. P.235-238.
  14. E.M.Savitskiy, V.B.Gribulya, and N.N.Kiselyova. Cybernetic prediction of inorganic compounds and its correlation with experiment // Crystal Res.& Technol. 1982. V.17, №1. P.3-17.
  15. N.N.Kiselyova , E.M.Savitskii . Prediction of formation of new silicides with ThCr2Si2-structure // Izvestiya Akad.Nauk SSSR, Neorganicheskie Materialy . 1983. V.19, N.3. P.489-491.
  16. E.M.Savitskii, N.N.Kiselyova. The search for criteria of chemical compound formation in salt systems using cybernetic methods // Dokladi Akad.Nauk SSSR . 1983. V.272, N.3. P.652-655.
  17. N.N.Kiselyova , E.M.Savitskii . Prediction of new phases in systems AHal2-BHal // Zh. Neorgan. Khimii . 1984. V.29, N.12. P.3104-3110.
  18. E.M.Savitskii, N.N.Kiselyova. Cybernetic prediction of new germanides of AB2Ge2 with crystal structure type ThCr2Si2 // Izvestiya Akad. Nauk SSSR, Metalli . 1984. N.1. P.191-194.
  19. E.M.Savitskii, N.N.Kiselyova. Prediction of crystal structure type of some equiatomic ternary compounds // Izvestiya Akad. Nauk SSSR, Metalli . 1985. N.5. P.182-184.
  20. V.B.Gribulya, N.N.Kiselyova. Principles of cybernetic prediction of inorganic phases // Direct and inverse problems of chemical thermodynamics. Novosibirsk: Nauka. 1987. P.88-97.
  21. N.N.Kiselyova, G.S.Burkhanov . Prediction of crystal phases in ternary systems with elements of 5th group using computer learning methods // Izvestiya Akad.Nauk SSSR, Neorganicheskie Materialy. 1987. V.23, N.12. P.2006-2011.
  22. N.N.Kiselyova. Prediction of Heusler-phases with composition ABD2 (D =Co, Ni, Cu, Pd) // Izvestiya Akad. Nauk SSSR, Metalli . 1987. N.2. P.213-215.
  23. N.N.Kiselyova, V.I.Lutsyk, V.P.Vorob’yova, et al. Cybernetic prediction of new compounds in systems AO-B2O3 // Dokladi Akad.Nauk SSSR . 1989. V.304, N.3. P.657-660.
  24. N.N.Kiselyova, G.S.Burkhanov . The search for new ternary phases with Al, Ga and In using information-predicting system // Izvestiya Akad. Nauk SSSR, Metalli . 1989. N.1. P.218-221.
  25. Prediction in Materials Science Using Computer / E.M.Savitskii, V.B.Gribulya, N.N.Kiselyova, et al. Moscow: Nauka, 1990. 86 c.
  26. N.N.Kiselyova. Intelligent information systems for designing of new materials // Upravlyayushchie Sistemy i Mashiny . 1992. № 5/6. P.125-130.
  27. N.N.Kiselyova. Information-predicting systems for the design of new materials // J.Alloys and Compounds. 1993. V.197, N.2. P.159-165.

  28. N.N.Kiselyova Prediction of Inorganic Compounds: Experiences and Perspectives // MRS Bull. 1993. V.18, N.2. P.40-43.
  29. N.N.Kiseleva. Forecasting new compounds of ABF5 type // Rus J.Inorg. Chem. 1997. V.42, №6. P.802-805.
  30. N.N.Kiselyova. Application of artificial intelligence methods to inorganic compounds design // Perspektivnye Materialy . 1997. №4. P.5-21.
  31. N.N.Kiselyova, N.D.Vashchenko V.P.Gladun, et al. Prediction of inorganic compounds promising for the search for new electro-optical materials // Perspektivnye Materialy. 1998. №3. P.28-32.
  32. N.N.Kiselyova, V.P.Gladun, and N.D.Vashchenko. Computational materials design using artificial intelligence methods // J.Alloys and Compounds. 1998. V.279, №1. P.8-13.

  33. N.N.Kiselyova. Application of artificial intelligence to predict inorganic compounds promising for the search of new materials of electronics // Artificial intelligence. 1999. №2. P.371-377.
  34. N.N.Kiselyova. Databases and semantic networks for the inorganic materials computer design // Engineering Application of Artificial Intelligence. 2000. №13. P.533-542.

  35. N.N.Kiselyova, S.R.LeClair, V.P.Gladun and N.D.Vashchenko. Application of semantic networks to the search for new electro-optical inorganic materials // IFAC Symposium on Artificial Intelligence in Real Time Control. AIRTC-2000, Preprints. 2000. P.31-36.
  36. N.N.Kiselyova. Design of inorganic compounds with use of databases and methods of computer learning // Trans. of Int. scientific-practical conference “KDS-2001” «Knowledge-Dialog-Solution». St.-Petersburg. 2001. P.288-294.
  37. N.N.Kiselyova Computer design of materials with artificial intelligence methods // Intermetallic Compounds. Vol.3. Principles and Practice. Ed.by J.H.Westbrook & R.L.Flescher. John Wiley &Sons, Ltd. 2002. P.811-839.

  38. N.N.Kiselyova. Computer design of inorganic substances with computer learning methods // Mathematical methods of pattern recognition (MMPR-11). Proc. of 11 th All-Russian Conf. Moscow: CCAS, 2003. P.323-326.
  39. N.N.Kiselyova. Computer design of inorganic compounds . Application of databases and artificial intelligence. Moscow: Nauka. 2005. 288 p.
  40. N.Kiselyova. Application of Artificial Intelligence Methods to Computer Design of Inorganic Compounds // Int. Journal “Information Theories & Applications”. 2005. V.12, №3. P.212-219.

  41. N.N.Kiselyova, V.A.Dudarev, A.V.Stolyarenko, V.S.Zemskov. Computer design of inorganic compounds promising for the search for new materials for electronics // Izvestiya VUZov. Materialy elektron . tekhniki . 2006. №3. P .61-68.
  42. Kiselyova N., Stolyarenko A., Ryazanov V., Podbel'skii V. Information-analytical system for design of new inorganic compounds // Int. Journal “Information Theories & Applications”. 2008. V.15. N.4. P.345-350.

  43. Kiselyova N.N., Stolyarenko A.V., Gu T., Lu W., Blansche A., Ryazanov V.V., Senko O.V. COMPUTER-AIDED DESIGN OF NEW INORGANIC COMPOUNDS PROMISING FOR SEARCH FOR ELECTRONIC MATERIALS // Proc. the Sixth International Conference on Computer-Aided Design of Discrete Devices (CAD DD-07), vol.1, Minsk: UIPI NASB. 2007. P.236-242.

  44. Kiselyova N.N., Stolyarenko A.V., Gu T., Lu W. Computer-aided design of new wide bandgap semiconductors with chalcopyrite structure // Perspektivnye Materialy. 2007. Special Ed.: Proc. IX Russian-Chinese Symp. New Materials and Technologies. P. 351-355.

  45. Kiseleva N.N. Prediction of Occurrence of AB3X3 (X = S, Se, Te) // Inorganic Materials. 2009. V.45. N.10. P.1077-1080.

  46. Kiselyova N.N., Podbel'skii V.V., Ryazanov V.V., Stolyarenko A.V. Computer-Aided Design of New Inorganic Compounds with Composition ABX2 (X = S, Se, Te) // Inorganic Materials: Applied Research. 2010. V.1. N.1. P.9-16.

  47. Kiselyova N.N., Stolyarenko A.V., Ryazanov V.V., Sen'ko O.V., Dokukin A.A., Podbel'skii V.V. A System for Computer-Assisted Design of Inorganic Compounds Based on Computer Training // Pattern Recognition and Image Analysis. 2011. V.21. N.1. P.88-94.

  48. Zhuravlev Yu.I., Kiselyova N.N., Ryazanov V.V., Sen'ko O.V., Dokukin A.A. Design of Inorganic Compounds with the Use of Precedent-Based Pattern Recognition Methods // Pattern Recognition and Image Analysis. 2011. V.21. N.1. P.95-103.

  49. Kiselyova N.N.,Sen’ko O.V.,Kropotov D.A.,Dokukin A.A. Computer-Aided Design of AD2X2 Intermetallics with a ThCr2Si2-Type of Crystal Structure // Russian Metallurgy (Metally). 2012. N.7. P.644–653.

  50. Kiselyova N.N., Stolyarenko A.V., Sen'ko O.V., Ryazanov V.V., Dokukin A.A. Prediction of New Inorganic Compounds with Composition ABX (X = As, Sn, Sb, Pb, or Bi) // Materialovedenie. 2012. N. 6. Ñ. 36-45.
  51. Kiselyova N.N., Stolyarenko A.V., Ryazanov V.V., Sen'ko O.V., Dokukin A.A. Application of Machine Training Methods to Design of New Inorganic Compounds // In monography: “Diagnostic Test Approaches to Machine Learning and Commonsense Reasoning Systems”. Ed. by X.A. Naidenova & D.I. Ignatov. Hershey: IGI Global. 2013. P. 197-220.

  52. Kiselyova N.N., Stolyarenko A.V., Sen'ko O.V., Dokukin A.A. Prediction of the Crystal Structure Types of Equiatomic Ternary Silicides and Germanides // Russian Metallurgy (Metally). 2013. N.5. P.381–388.

  53. Kiselyova N.N., Stolyarenko A.V., Ryazanov V.V., Sen'ko O.V., Dokukin A.A., Podbel'skii V.V. Prediction of New Compounds in the AHal–BHal3 Systems // Rus J.Inorg. Chem., 2014. V.59. N.12. P.1462–1471.

  54. Kiselyova N.N., Stolyarenko A.V., Sen'ko O.V., Ryazanov V.V., Dokukin A.A. Prediction of New Halo-Elpasolites // Russ. J. Inorg. Chem. 2016. V. 61. N. 5. P. 604-609.
  55. 2. Kiseleva N.N., Stolyarenko A.V., Ryazanov V.V., Sen’ko O. V., Dokukin A.A. Prediction of New A3+B3+C2+O4 Compounds // Russ. J. Inorg. Chem. 2017. V. 62. N. 8. P.1058–1066.