Structure of Matter and Quantum Chemistry

Issue Title File
Vol 91, No 5 (2017) Estimating electron affinity from the lifetime of negative molecular ions: Cycloheptatriene derivatives PDF
(Eng)
Asfandiarov N.L., Pshenichnyuk S.A., Vorob’ev A.S., Nafikova E.P., Mavrodiev V.K., Furlei I.I., Dokichev V.A., Platonov D.N., Belyy A.Y.
Vol 91, No 5 (2017) Motion of a lithium ion over a graphene–silicene channel: A computer model PDF
(Eng)
Rakhmanova O.R., Galashev A.E.
Vol 91, No 4 (2017) Complexation equilibria in tetrahydrofuran solutions of palladium(II) and lithium bromides PDF
(Eng)
Putin A.Y., Katsman E.A., Temkin O.N., Bruk L.G.
Vol 91, No 4 (2017) Formation of solvate structures by the ortho-, meta-, and para-isomers of hydroxybenzoic acid in supercritical fluid PDF
(Eng)
Antipova M.L., Gurina D.L., Odintsova E.G., Petrenko V.E.
Vol 91, No 4 (2017) UV–Vis spectra and structure of acid-base forms of dimethylamino- and aminoazobenzene PDF
(Eng)
Mikheev Y.A., Guseva L.N., Ershov Y.A.
Vol 91, No 4 (2017) Low-temperature heat capacity and Schottky anomaly of ErVO4 PDF
(Eng)
Gavrichev K.S., Ryumin M.A., Tyurin A.V., Nikiforova G.E., Gus’kov V.N., Kritskaya A.P., Bryukhanova K.I., Gagarin P.G.
Vol 91, No 4 (2017) Nuclear magnetic and nuclear quadrupole resonance parameters of β-carboline derivatives calculated using density functional theory PDF
(Eng)
Ahmadinejad N., Tari M.T.
Vol 91, No 3 (2017) Visible and near-IR spectroscopy of endohedral Gd@C82(C2v) and Ho@C82(C2v) metallofullerenes and their monoanions PDF
(Eng)
Kareev I.E., Nekrasov V.M., Dutlov A.E., Martynenko V.M., Bubnov V.P., Laukhina E., Veciana J., Rovira C.
Vol 91, No 3 (2017) Composition and structure of Pt chloride complexes in hydrothermal solutions, according to X-ray absorption spectroscopy PDF
(Eng)
Tagirov B.R., Trigub A.L., Selivanov P.V., Koroleva L.A.
Vol 91, No 2 (2017) Molecular mechanisms of decomposition of hydrated Na+Cl ion pairs under planar nanopore conditions PDF
(Eng)
Shevkunov S.V.
Vol 91, No 2 (2017) Vertical growth of cadmium sulfide crystals on a silicon substrate PDF
(Eng)
Belyaev A.P., Rubets V.P., Antipov V.V.
Vol 91, No 2 (2017) Quantum-chemical study of the effect of ligands on the structure and properties of gold clusters PDF
(Eng)
Golosnaya M.N., Pichugina D.A., Oleinichenko A.V., Kuz’menko N.E.
Vol 91, No 2 (2017) Conformation equilibrium of 3-(hydroxymethyl)piperidine in solvents with different polarity PDF
(Eng)
Korneichuk A.Y., Senyavin V.M., Kuramshina G.M.
Vol 91, No 2 (2017) Study of 5-azidomethyl-8-hydroxyquinoline structure by X-ray diffraction and HF–DFT computational methods PDF
(Eng)
Bougharraf H., Benallal R., Sahdane T., Mondieig D., Negrier P., Massip S., Elfaydy M., Lakhrissi B., Kabouchi B.
Vol 91, No 2 (2017) The delay time dependence of the photoelectron spectra and state populations of three-level ladder K2 molecule PDF
(Eng)
Guo W., Lu X., Wang X.
Vol 91, No 1 (2017) Conformations and properties of O-Alkyl-S-(2-N,N-dialkylamino)-ethylmethylthiophosphonates PDF
(Eng)
Strukov O.G., Kondrat’ev V.B., Vlasova Z.V., Petrunin V.A.
Vol 91, No 1 (2017) Two crystalline polymorphic forms of α-(N-benzoxazolin-2-one)acetic acid PDF
(Eng)
Ashurov J.M., Izotova L.Y., Ibragimov B.T., Mukhamedov N.S.
Vol 91, No 1 (2017) Structure of alcohol cluster ions in the gas phase, according to spectrometry and ab initio calculations PDF
(Eng)
Krisilov A.V., Lantsuzskaya E.V., Levina A.M.
Vol 91, No 1 (2017) A DFT study on graphyne fluorination PDF
(Eng)
Hosseini J., Bodaghi A., Soleymanabadi H.
Vol 90, No 13 (2016) DFT studies on structural properties and electron density topologies of the iron selenides FemSen (1 ≤ m, n ≤ 4) PDF
(Eng)
Zhang J., Liu J.
Vol 90, No 13 (2016) A theoretical study of high-pressure-induced phases of LiAlH4 using calculated NQCC parameters PDF
(Eng)
Rafiee M.A.
Vol 90, No 13 (2016) Analysis of the [CuLn]2+ and [CuGn]2+ (n = 2–4) complex structures: Comparison with CID experiment and DFT calculation PDF
(Eng)
Zhang S., Liu H., Cheng P., Ren D., Gong X.
Vol 90, No 13 (2016) Synthesis, photophysical, and electrochemical properties of wide band gap tetraphenylsilane-carbazole derivatives: Effect of the substitution position and naphthalene side chain PDF
(Eng)
Ho K.W., Ariffin A.
Vol 90, No 13 (2016) Search for the structures, stabilities, IR spectra, and thermodynamic properties of the asymmetric clusters (HClBN3)n (n = 1–6) PDF
(Eng)
Wang A., Chen Z., Ma D., Xia Q.
Vol 90, No 13 (2016) Theoretical calculations of high-pressure phases of NiF2: An ab initio constant-pressure study PDF
(Eng)
Kürkçü C., Merdan Z., Öztürk H.
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