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La ricerca find articoli where soggetti phrase all words 'matrix isolation' sort by level,fasc_key/DESCEND, pagina_ini_num/ASCEND ha restituito 788 riferimenti
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    1. Yekeler, H; Ozbakir, D
      Concerning the solvent effect in the tautomerism of uracil, 5-fluorouracil, and thymine by density-functional theory and ab initio calculations

      JOURNAL OF MOLECULAR MODELING
    2. Himmel, HJ; Downs, AJ; Green, JC; Greene, TM
      Compounds featuring a bond between a Group 13 (M) and a Group 15 element (N or P) and with the formulae HmMNHn and HmMPHn: structural aspects and bonding

      JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS
    3. Schriver-Mazzuoli, L
      Ozone photochemistry in the condensed phase

      PHYSICS AND CHEMISTRY OF THE EARTH PART C-SOLAR-TERRESTIAL AND PLANETARY SCIENCE
    4. Rostkowska, H; Nowak, MJ; Lapinski, L; Adamowicz, L
      IR spectral and theoretical characterization of intramolecular hydrogen bonds closing five-membered rings

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    5. Zink, R; Tekautz, G; Kleewein, A; Hassler, K
      Gauche, ortho, transoid and anti conformations of the tetrasilanes SiMe3SiX2SiX2SiMe3 (X = H, F, Cl, Br, I): A computational and vibrational spectroscopic study

      CHEMPHYSCHEM
    6. Limberg, C; Downs, AJ; Greene, TM; Wistuba, T
      The photochemistry of [CpMo(CO)(3)(eta(1)-C3H5)] in frozen gas matrices at10K and the behaviour of [CpMo(CO)(2) (eta(3)-C3H5)] isomers in different media

      EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
    7. Bitterwolf, TE; Bays, JT; Scallorn, B; Weiss, CA; George, MW; Virrels, IG; Linehan, JC; Yonker, CR
      Organic matrix and solution photochemical studies of (allyl)dicarbonyl(cyclopentadienyl)molybdenum compounds

      EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
    8. Sander, W; Strehl, A; Winkler, M
      Photochemistry of bis(sulfonyl)diazomethanes

      EUROPEAN JOURNAL OF ORGANIC CHEMISTRY
    9. Roser, C; Albers, R; Sander, W
      Rearrangements of 2-furfurylidenes - Synthesis of acylsilanes and acylstannanes

      EUROPEAN JOURNAL OF ORGANIC CHEMISTRY
    10. Bucher, G
      Photochemical generation of iminoquinone methides by 1,4-hydrogen migration in derivatives of o-tolylnitrene

      EUROPEAN JOURNAL OF ORGANIC CHEMISTRY
    11. Bucher, G
      A laser flash photolysis study on 2-azido-N,N-diethylbenzylamine - The reactivity of iminoquinone methides in solution

      EUROPEAN JOURNAL OF ORGANIC CHEMISTRY
    12. Danovich, D; Ogliaro, F; Karni, M; Apeloig, Y; Cooper, DL; Shaik, S
      Silynes (RC equivalent to SiR ') and disilynes (RSi equivalent to SiR '): Why are less bonds worth energetically more?

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    13. Lee, H; Knobler, CB; Hawthorne, MF
      A hydrogen-bonded [(mercuracarborand-water)(2)- benzene] pi-sandwich complex

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    14. Poliakoff, M; Turner, JJ
      The structure of [Fe(CO)(4)] - An important new chapter in a long-running story

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    15. Wenk, HH; Balster, A; Sander, W; Hrovat, DA; Borden, WT
      Matrix isolation of perfluorinated p-benzyne

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    16. Klotzbucher, WE; Petrukhina, MA; Nemukhin, AV; Ermilov, AY; Grigorenko, BL
      Formation of mixed d- and f-block metal clusters in inert matrices: comparison of the observed and theoretical optical spectra of AgHo

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    17. Stepanenko, T; Lapinski, L; Nowak, MJ; Kwiatkowski, JS; Leszczynski, J
      Tautomerism and infrared spectra of 2-thiopurine: an experimental matrix isolation and theoretical ab initio and density functional theory study

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    18. Ha, TK; Gunthard, HH
      Quantum chemistry predicted correlations between geometric isomerism (conformation) of -OH and =NH substituents and typical group frequencies of nucleic acid bases: cytosine

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    19. Naumov, P; Jovanovski, G
      An update to the combined vibrational-diffraction experimental and theoretical studies of small biologically important cyclic imides: Reference to saccharin

      CURRENT ORGANIC CHEMISTRY
    20. Tan, XF; Dagdigian, PJ; Alexander, MH
      Electronic spectroscopy and excited state dynamics of the Al-H-2/D-2 complex

      FARADAY DISCUSSIONS
    21. Jones, C
      The stabilisation and reactivity of indium trihydride complexes

      CHEMICAL COMMUNICATIONS
    22. Kraft, BJ; Zaleski, JM
      Photoinduced diradical formation and decay in uncomplexed and metal-bound benzotriazine systems: mechanistic implications to chemically and biologically relevant photochemistry

      NEW JOURNAL OF CHEMISTRY
    23. Kryachko, ES; Nguyen, MT; Zeegers-Huyskens, T
      Theoretical study of tautomeric forms of uracil. 1. Relative order of stabilities and their relation to proton affinities and deprotonation enthalpies

      JOURNAL OF PHYSICAL CHEMISTRY A
    24. Cardelino, BH; Moore, CE; Cardelino, CA; Frazier, DO; Bachmann, KJ
      Theoretical study of indium compounds of interest for organometallic chemical vapor deposition

      JOURNAL OF PHYSICAL CHEMISTRY A
    25. Zhou, MF; Zhang, LN; Shao, LM; Wang, WN; Fan, KN; Qin, QZ
      Formation and characterization of the (eta(2)-H-2)CrO2, (eta(2)-H-2)(2)CrO2 and HCrO(OH) molecules

      JOURNAL OF PHYSICAL CHEMISTRY A
    26. Tsuji, H; Toshimitsu, A; Tamao, K; Michl, J
      UV, MCD, and LD spectra of a conformationally constrained ortho-tetrasilane: Support for the avoided crossing model of conformational effects on excited states

      JOURNAL OF PHYSICAL CHEMISTRY A
    27. Everaert, GP; Herrebout, WA; van der Veken, BJ
      Ab initio and cryospectroscopic investigation of the Van der Waals complexes of methyleyclopropane with hydrogen chloride and boron trifluoride

      JOURNAL OF PHYSICAL CHEMISTRY A
    28. Michalska, D; Zierkiewicz, W; Bienko, DC; Wojciechowski, W; Zeegers-Huyskens, T
      "Troublesome" vibrations of aromatic molecules in second-order Moller-Plesset and density functional theory calculations: Infrared spectra of phenol and phenol-OD revisited

      JOURNAL OF PHYSICAL CHEMISTRY A
    29. Alikhani, ME; Krim, L; Manceron, L
      Infrared spectra and structures of nickel and palladium dinitrosyl complexes isolated in solid argon

      JOURNAL OF PHYSICAL CHEMISTRY A
    30. Saltiel, J; Sears, DF; Turek, AM
      UV spectrum of the high energy conformer of 1,3-butadiene in the gas phase

      JOURNAL OF PHYSICAL CHEMISTRY A
    31. Ding, YH; Li, ZS; Huang, XR; Sun, CC
      Theoretical study on structures and stability of HCCNN+ isomers

      JOURNAL OF PHYSICAL CHEMISTRY A
    32. Kryachko, ES; Zeegers-Huyskens, T
      Theoretical study of the CH center dot center dot center dot O interactionin fluoromethanes center dot H2O and chloromethanes center dot H2O complexes

      JOURNAL OF PHYSICAL CHEMISTRY A
    33. Zhou, MF; Zhang, LN; Qin, QZ
      Chromium oxide complexes with dinitrogen. Formation and characterization of the (NN)(x)CrO and (NN)(x)CrO2 (x=1,2)

      JOURNAL OF PHYSICAL CHEMISTRY A
    34. Patchkovskii, S; Ziegler, T
      Calculation of the EPR g-tensors of high-spin radicals with density functional theory

      JOURNAL OF PHYSICAL CHEMISTRY A
    35. Hartmann, M; Wetmore, SD; Radom, L
      C-H center dot center dot center dot X hydrogen bonds of acetylene, ethylene, and ethane with first- and second-row hydrides

      JOURNAL OF PHYSICAL CHEMISTRY A
    36. Wang, JQ; Long, GT; Weitz, E
      Real time infrared spectroscopic probe of the reactions of Fe(CO)(3) and Fe(CO)(4) with N-2 in the gas phase

      JOURNAL OF PHYSICAL CHEMISTRY A
    37. Timoshkin, AY; Bettinger, HF; Schaefer, HF
      DFT modeling of chemical vapor deposition of GaN from organogallium precursors. 1. Thermodynamics of elimination reactions

      JOURNAL OF PHYSICAL CHEMISTRY A
    38. Papayannis, DK; Kosmas, AM; Melissas, VSR
      Quantum mechanical studies on the BrO plus ClO reaction

      JOURNAL OF PHYSICAL CHEMISTRY A
    39. Kryachko, ES; Nguyen, MT; Zeegers-Huyskens, T
      Theoretical study of uracil tautomers. 2. Interaction with water

      JOURNAL OF PHYSICAL CHEMISTRY A
    40. Akai, N; Kudoh, S; Takayanagi, M; Nakata, M
      Photoreaction mechanisms of 2-chlorophenol and its multiple chloro-substituted derivatives studied by low-temperature matrix-isolation infrared spectroscopy and density-functional-theory calculations

      JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY
    41. Sato, T; Niino, H; Yabe, A
      Reactive intermediates formed by the consecutive photolyses of naphthalenetetracarboxylic dianhydrides: direct observation of reactive intermediates generated by laser-induced reaction in low-temperature argon matrices

      JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY
    42. Polikarpov, EV; Granovsky, AA; Nemukhin, AV
      On the potential-energy surface of the Mg+CO2 (C-2 nu) system

      MENDELEEV COMMUNICATIONS
    43. Wenk, HH; Sander, W
      Matrix isolation and spectroscopic characterization of perfluorinated ortho- and meta-benzyne

      CHEMISTRY-A EUROPEAN JOURNAL
    44. Wistuba, T; Limberg, C
      The reaction of permanganyl chloride with olefins: Intermediates and mechanism as derived from matrix-isolation studies and density functional theorycalculations

      CHEMISTRY-A EUROPEAN JOURNAL
    45. Stepanenko, T; Lapinski, L; Nowak, MJ; Adamowicz, L
      Infrared spectra of syn and anti isomers of benzaldoxime and pyridine-4-aldoxime: an experimental matrix isolation and theoretical density functionaltheory study

      VIBRATIONAL SPECTROSCOPY
    46. Cacela, C; Fausto, R; Duarte, ML
      A combined matrix-isolation infrared spectroscopy and MO study of 1-amino-2-propanol

      VIBRATIONAL SPECTROSCOPY
    47. Bucher, G; Wandel, H; Sander, W
      1,4-Naphthoquinonediazide-2-carboxylic acid: a diazo compound with a long-lived triplet excited state

      JOURNAL OF PHYSICAL ORGANIC CHEMISTRY
    48. Ihm, H; Scheer, K; Celio, H; White, JM
      Alkoxide synthesis from methyl and tert-butyl nitrite on Cu(100)

      LANGMUIR
    49. Crepin, C; Tramer, A
      Site effect on radiative and non-radiative relaxation paths of naphthalenein low-temperature matrices

      CHEMICAL PHYSICS
    50. Crepin, C; de Pujo, P; Bouvier, B; Brenner, V; Millie, P
      A simulation of naphthalene matrix isolation: comparison with experiments

      CHEMICAL PHYSICS
    51. Kryachko, ES; Nguyen, MT; Zeegers-Huyskens, T
      Density functional calculations on protonated and deprotonated thiouracilsand their complexes with water

      CHEMICAL PHYSICS
    52. Fisher, L; Holme, T
      MM3 parameterization for the B-N dative bond

      JOURNAL OF COMPUTATIONAL CHEMISTRY
    53. Cheng, BM; Liu, CP; Lo, WJ; Lee, YP
      Photodissociation thresholds of OH produced from CH3OH in solid neon and argon

      NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION A-ACCELERATORS SPECTROMETERS DETECTORS AND ASSOCIATED EQUIPMENT
    54. Erkoc, S
      Interaction of nitric oxide with elements

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    55. Del Bene, JE; Jordan, MJT
      What a difference a decade makes: progress in ab initio studies of the hydrogen bond

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    56. Dunne, JP; Fox, S; Tacke, M
      A DFT study on structures of aryl calcium hydride in donor solvents

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    57. Shao, LM; Chen, MH; Zhou, MF
      DFT study on the structures, stabilities and vibrational frequencies of the CS2-XO- (X = C, N, O) anions

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    58. Vayner, E; Ball, DW
      The energetics of the interaction of nitric oxide with alkali metal atoms

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    59. Kryachko, ES; Nguyen, MT
      Thiouracils: Structures, tautomerism, interaction with water, and functioning in RNA and modified DNA base pairs

      ADVANCES IN QUANTUM CHEMISTRY, VOL 40: NEW PERSPECTIVES IN QUANTUM SYSTEMSIN CHEMISTRY AND PHYSICS, PT 2
    60. Schnockel, H; Schnepf, A
      From AIX/GaX monohalide molecules to metalloid aluminum and gallium clusters

      ADVANCES IN ORGANOMETALLIC CHEMISTRY, VOL 47
    61. Bauerecker, S; Taraschewski, M; Weitkamp, C; Cammenga, HK
      Liquid-helium temperature long-path infrared spectroscopy of molecular clusters and supercooled molecules

      REVIEW OF SCIENTIFIC INSTRUMENTS
    62. Lee, VY; Ichinohe, M; Sekiguchi, A
      Reaction of disilagermirenes with phenylacetylene: from a germasilene -Ge=Si- to a metalladiene of the type -Si=Ge-C=C-

      JOURNAL OF ORGANOMETALLIC CHEMISTRY
    63. Doyle, KO; Gallagher, ML; Pryce, MT; Rooney, AD
      A matrix isolation and flash photolysis study of the cyclization reactionsof chromium amino carbenes

      JOURNAL OF ORGANOMETALLIC CHEMISTRY
    64. Laxer, A; Major, DT; Gottlieb, HE; Fischer, B
      (N-15(5))-labeled adenine derivatives: Synthesis and studies of tautomerism by N-15 NMR spectroscopy and theoretical calculations

      JOURNAL OF ORGANIC CHEMISTRY
    65. Bjerkeseth, LH; Bakke, JM; Uggerud, E
      Inter- and intramolecular O-H center dot center dot center dot pi hydrogenbonding in the methanol-ethene complex and syn-7-norbornenol, probed by IR, H-1 NMR and quantum chemistry

      JOURNAL OF MOLECULAR STRUCTURE
    66. Fausto, R; Macoas, EMS
      Photochemical reactivity of matrix-isolated monomeric carboxylic acids

      JOURNAL OF MOLECULAR STRUCTURE
    67. Isoniemi, E; Khriachtchev, L; Lundell, J; Rasanen, M
      Photochemistry of H2S/SO2 mixtures in solid krypton

      JOURNAL OF MOLECULAR STRUCTURE
    68. Ramaekers, R; Maes, G; Adamowicz, L; Dkhissi, A
      Matrix-isolation FT-IR study and theoretical calculations of the vibrational, tautomeric and H-bonding properties of hypoxanthine

      JOURNAL OF MOLECULAR STRUCTURE
    69. Prince, BJ; Williamson, BE; Reeves, RJ
      Aggregation and site-selective spectroscopy of matrix-isolated metallophthalocyanines

      JOURNAL OF LUMINESCENCE
    70. Tam, S; Fajardo, ME
      CO/pH(2): A molecular thermometer

      JOURNAL OF LOW TEMPERATURE PHYSICS
    71. Fraenk, W; Klapotke, TM
      Theoretical studies on the thermodynamic stability and trimerization of BF2N3

      JOURNAL OF FLUORINE CHEMISTRY
    72. Chang, HC; Jiang, JC; Lin, SH; Weng, NH; Chao, MC
      Evidence for C-H-O interaction of acetone and deuterium oxide probed by high-pressure

      JOURNAL OF CHEMICAL PHYSICS
    73. Fajardo, ME; Tam, S
      Observation of the cyclic water hexamer in solid parahydrogen

      JOURNAL OF CHEMICAL PHYSICS
    74. Ma, YM; Cui, T; Zou, GT
      Effects of pressure on the trapping site structures and absorption spectraof Li in solid H-2: A path integral Monte Carlo study

      JOURNAL OF CHEMICAL PHYSICS
    75. Lee, HM; Suh, SB; Kim, KS
      Structures, energies, and vibrational spectra of water undecamer and dodecamer: An ab initio study

      JOURNAL OF CHEMICAL PHYSICS
    76. Tan, XF; Dagdigian, PJ; Williams, J; Alexander, MH
      Experimental and theoretical investigation of the rotational structure of the Al-H-2/D-2 complex

      JOURNAL OF CHEMICAL PHYSICS
    77. Ford, TA; Glasser, L
      Ab initio calculations of the structural, energetic, and vibrational properties of some hydrogen bonded and van der Waals dimers. Part 4. The acetonitrile dimer

      INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
    78. Podolyan, Y; Rubin, YV; Leszczynski, J
      An ab initio post-Hartree-Fock study of vibrational infrared spectra of 5-azacytosine and cytosine

      INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
    79. Himmel, HJ; Downs, AJ; Greene, TM
      Reactions of aluminum, gallium, and indium (M) atoms with phosphine: Generation and characterization of the species M center dot PH3, HMPH2, and H2MPH

      INORGANIC CHEMISTRY
    80. Bitterwolf, TE
      Mechanisms and intermediates in the photochemistry of M-2(CO)(6)(eta(5)-C5H5)(2), where M = Cr, Mo and W, and their ring-coupled analogs

      COORDINATION CHEMISTRY REVIEWS
    81. Chao, MC; Weng, NH; Chang, HC; Jiang, JC; Lin, SH
      High-pressure and concentration-dependent studies on C-H---O interactions of binary aqueous mixtures: Formic acid/D2O and acetone/D2O

      JOURNAL OF THE CHINESE CHEMICAL SOCIETY
    82. Furutaka, S; Kondo, H; Ikawa, S
      Infrared spectroscopic study of water-aromatic hydrocarbon mixtures at high temperatures and pressures.

      BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN
    83. Aldridge, S; Downs, AJ
      Hydrides of the main-group metals: New variations on an old theme

      CHEMICAL REVIEWS
    84. Borget, F; Chiavassa, T; Aycard, JP
      Photoreactivity on a water ice surface: cyanoacetylene (HC3N) reaction with atomic oxygen issued from the photodissociation of ozone (O-3) at 255 nm

      CHEMICAL PHYSICS LETTERS
    85. Cremer, D; Kraka, E; Crehuet, R; Anglada, J; Grafenstein, J
      The ozone-acetylene reaction: concerted or non-concerted reaction mechanism? A quantum chemical investigation

      CHEMICAL PHYSICS LETTERS
    86. Filippone, F; Parrinello, M
      Vibrational analysis from linear response theory

      CHEMICAL PHYSICS LETTERS
    87. Hwang, DY; Mebel, AM
      Theoretical study of the reaction mechanism of ScO with molecular hydrogen

      CHEMICAL PHYSICS LETTERS
    88. Lo, WJ; Lee, YP
      Ultraviolet absorption spectrum of cyclic CS2 in solid Ar

      CHEMICAL PHYSICS LETTERS
    89. Nakamura, M; Ito, M
      Coadsorption of water monomers with CO on Ru(001) and charge transfer during hydration processes

      CHEMICAL PHYSICS LETTERS
    90. Andrews, L; Liang, BY
      Infrared spectrum of the hyponitrite dianion, N2O22-, isolated and insulated from stabilizing metal cations in solid argon

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    91. Russo, N; Toscano, M; Grand, A
      Bond energies and attachments sites of sodium and potassium cations to ONAand RNA nucleic acid bases in the gas phase

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    92. Peterson, TH; Golden, JT; Bergman, RG
      Evidence for the intervention of different C-H activating intermediates inthe irradiation of (eta(5)-C5Me5)(PMe3)IrH2 and the reaction of (eta(5)-C5Me5)(PMe3)Ir(H) (Cl) with strong base. Detection and spectroscopic characterization of (eta(5)-C5Me5) (PMe3)Ir(Li)(Cl), an intermediate in the dehydrohalogenation reaction

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    93. Cremer, D; Crehuet, R; Anglada, J
      The ozonolysis of acetylene - A quantum chemical investigation

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    94. Yang, H; Snee, PT; Kotz, KT; Payne, CK; Harris, CB
      Femtosecond infrared study of the dynamics of solvation and solvent caging

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    95. Sergeev, GB; Shabatina, TI; Solov'ev, VN; Zagorskii, VV
      Reactions of solid organic compounds with metal species

      MOLECULAR CRYSTALS AND LIQUID CRYSTALS
    96. Gu, J; Tian, A; Li, WK; Wong, NB
      Intramolecular proton transfer in the tautomers of C8 oxidative adenine: ADFT study

      JOURNAL OF PHYSICAL CHEMISTRY B
    97. Childs, GI; Colley, CS; Dyer, J; Grills, DC; Sun, XZ; Yang, JX; George, MW
      Investigation into the reactivity of M(eta(5)-C5R5)(CO)(2)(alkane) (M = Mnor Re; R = H, Me or Ph; alkane = n-heptane or cyclopentane) and Re(eta(5)-C5H5)(CO)(2)(Xe) in solution at cryogenic and room temperature

      JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS
    98. Bencivenni, L; Ramondo, F; Pieretti, A; Sanna, N
      On the hydrogen bonding in uracil: its effect on the vibrational spectrum

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    99. Aloisio, S; Francisco, JS
      The role of complexes of water and carbonyl containing molecules in the atmosphere

      PHYSICS AND CHEMISTRY OF THE EARTH PART C-SOLAR-TERRESTIAL AND PLANETARY SCIENCE
    100. George, WO; Jones, BF; Lewis, R; Price, JM
      Computations of medium strength hydrogen bonds-complexes of mono- and bi-functional carbonyl and nitrile compounds with hydrogen chloride

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS


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Documento generato il 16/01/21 alle ore 07:42:34