Bibliography for SiH2
  1. Clark, V.H.J., Owens, A., Tennyson, J., Yurchenko, S.N., "The high-temperature rotation-vibration spectrum and rotational clustering of silylene (SiH2)", Journal of Quantitative Spectroscopy and Radiative Transfer In press (2020).
  2. Wu, Y., Zhang, C., Ma, H., "Ab initio conical intersections for the Si (1D) + H2 reaction system: A lowest five singlet states study", RSC Advances 7, 12074-12084 (2017). [link to article][17WuZhCh.SiH2]
  3. Kokkin, D. L., Ma, T., Steimle, T., Sears, T. J., "Detection and characterization of singly deuterated silylene, SiHD, via optical spectroscopy", Journal of Chemical Physics 144, 244304 (2016). [link to article][16KoMaSt.SiH2]
  4. Zaari, R. R., Varganov, S. A., "Nonadiabatic transition state theory and trajectory surface hopping dynamics: Intersystem crossing between 3B1 and 1A1 states of SiH2", Journal of Physical Chemistry A 119, 1332-1338 (2015). [link to article][15ZaVaxx.SiH2]
  5. Shi, D.-H., Zhang, J.-P., Sun, J.-F., Liu, Y.-F., Zhu, Z.-L., "Analytic potential energy function of the SiH2 (C2v, X 1A1) radical using CCSD(T) theory in combination with quintuple correlation-consistent basis set", Acta Physica Sinica 58, 5329-5334 (2009). [link to article][09ShZhSu.SiH2]
  6. Jiang, L.-J., Lu, Y.-F., Lu, Z.-Z., Han, X.-Q., "The structure and potential energy function investigation on SiX2 (X = H, F) molecules", Acta Physica Sinica 58, 201-208 (2009). [link to article][09JiLuZh.SiH2]
  7. Feng, X., Zhu, Z.-H., Liu, X.-Y., Yang, X.-D., Huang, W., "Theoretical study on molecular reaction dynamics of the SiH2 system", Acta Physica Sinica 58, 8217-8223 (2009). [link to article][09XiZhXi.SH2]
  8. Tokue, I., Yamasaki, K., Nanbu, S., "Isotope effects in the dissociation of the B̃ 1A1 state of SiH2, SiHD and SiD2 using three-dimensional wave packet propagation", Journal of Chemical Physics 124, 114308 (2006). [link to article][06ToYaNa.SiH2]
  9. Guerout, R., Bunker, P. R., Jensen, P., Kraemer, W. P., "A calculation of the rovibronic energies and spectrum of the B̃ 1A1 electronic state of SiH2", Journal of Chemical Physics 123, 244312 (2005). [link to article][05GuBuJe.SiH2]
  10. Muramoto, Y., Ishikawa, H., Mikami, N., "First observation of the B̃ 1A1 state of SiH2 and SiD2 radicals by optical-optical double resonance spectroscopy", Journal of Chemical Physics 122, 154302 (2005). [link to article][05MuIsMi.SiH2]
  11. Tokue, I., Yamasaki, K., Nanbu, S., "Vibrational energies for the X̃ 1A1, Ã 1B1, and B̃ 1A1 states of SiH2 ∕ SiD2 and related transition probabilities based on global potential energy surfaces", Journal of Chemical Physics 122, 144307 (2005). [link to article][05ToYaNa.SiH2]
  12. Yurchenko, S. N., Bunker, P. R., Kraemer, W. P., Jensen, P., "The spectrum of singlet SiH2", Canadian Journal of Chemistry 82, 694-708 (2004). [link to article][04YuBuKr.SiH2]
  13. Hirata, S., Yanai, T., de Jong, W. A., Nakajima, T., Hirao, K., "Third-order Douglas-Kroll relativistic coupled-cluster theory through connected single, double, triple, and quadruple substitutions: Applications to diatomic and triatomic hydrides", Journal of Chemical Physics 120, 3297-3310 (2004). [link to article][04HiYaJo.SiH2]
  14. Kalemos, A., Dunning, T. H., Mavridis, A., "SiH2: A critical study", Molecular Physics 102, 2597-2606 (2004). [link to article][04KaDuMa.SiH2]
  15. Apeloig, Y., Pauncz, R., Karni, M., West, R., Steiner, W., Chapman, D., "Why is methylene a ground state triplet while silylene is a ground state singlet?", Organometallics 22, 3250-3256 (2003). [link to article][03ApPaKa.SiH2]
  16. Nakajima, M., Kawai, A., Fukushima, M., Obi, K., "LIF spectroscopy and dissociation dynamics of the SiH2 radical in the A 1B1 (1, v2, 0) state", Chemical Physics Letters 364, 99-107 (2002). [link to article][02MNaKaFu.SiH2]
  17. Ishikawa, H., Muramoto, Y., Mikami, N., "Stimulated emission pumping spectroscopy of SiH2: First observation of the spin–orbit interaction between the X̃ 1A1 and the ã 3B1 states", Journal of Molecular Spectroscopy 216, 90-97 (2002). [link to article][02IsMuMi.SiH2]
  18. Gaspar, P. P., Xiao, M. C., Pae, D. H., Berger, D. J., Haile, T., Chen, T. Q., Lei, D. Q., Winchester, W. R., Jiang, P., "The quest for triplet ground state silylenes", Journal of Organometallic Chemistry 646, 68-79 (2002). [link to article][02GaXiPa.SiH2]
  19. Makowe, J., Boyarkin, O. V., Rizzo, T. R., "Collision-free infrared multiphoton dissociation of silane", Journal of Physical Chemistry A 104, 11505-11511 (2000). [link to article][00MaBoRi.SiH2]
  20. Pak, C., Rienstra-Kiracofe, J. C., Schaefer, H. F., "Electron affinities of silicon hydrides: SiHn (n = 0-4) and Si2Hn (n = 0-6)", Journal of Physical Chemistry A 104, 11232-11242 (2000). [link to article][00PaRiSc.SiH2]
  21. Hirota, E., Ishikawa, H., "The vibrational spectrum and molecular constants of silicon dihydride SiH2 in the ground electronic state", Journal of Chemical Physics 110, 4254-4257 (1999). [link to article][99HiIsxx.SiH2]
  22. Pittner, J., Nachtigall, P., Carsky, P., Masik, J., Hubac, I., "Assessment of the single-root multireference Brillouin–Wigner coupled- cluster method: Test calculations on CH2, SiH2 and twisted ethylene", Journal of Chemical Physics 110, 10275-10282 (1999). [link to article][99PiNaCa.SiH2]
  23. Escribano, R., Campargue, A., "Absorption spectroscopy of SiH2 near 640 nm", Journal of Chemical Physics 108, 6249-6257 (1998). [link to article][98EsCaxx.SiH2]
  24. Havlas, Z., Downing, J. W., Michl, J., "Spin-orbit coupling in biradicals. 2. Ab initio methodology and application to 1,1-biradicals: Carbene and silylene", Journal of Physical Chemistry A 102, 5681-5692 (1998). [link to article][98HaDoMi.SiH2]
  25. Campargue, A., Romanini, D., Sadeghi, N., "Measurement of SiH2 density in a discharge by intracavity laser absorption spectroscopy and CW cavity ring-down spectroscopy", Journal of Physics D: Applied Physics 31, 1168-1175 (1998). [link to article][98CaRoSa.SiH2]
  26. Gupte, G. R., Prasad, R., "Ground state geometries and vibrational spectra of small hydrogenated silicon clusters using nonorthogonal tight-binding molecular dynamics", International Journal of Modern Physics B 12, 1607-1622 (1998). [link to article][98GuPrxx.SiH2]
  27. Zaitsevskii, A., Malrieu, J. P., "Spin-adapted multipartitioning perturbation theory", Theoretical Chemistry Accounts 96, 269-276 (1997). [link to article][97ZaMaxx.ScH]
  28. Yamaguchi, Y., Van Huis, T. J., Sherrill, C. D., Schaefer, H. F., "The (X)over-tilde(1)A(1), (a)over-tilde(3)B(1), (A)over-tilde(1)B(1), and (B)over-tilde(1)A(1) electronic states of SiH2", Theoretical Chemistry Accounts 97, 341-349 (1997). [link to article][97YaVaSh.SiH2]
  29. Rubtsov, N. M., Azatyan, V. V., Tsvetkov, G. I., Temchin, S. M., "Detection of SiH2 from the A(1)B(1)-X(1)A(1) transition in the emission spectrum of the rarified flame in the oxidation of silane", Mendeleev Communications, 187-188 (1997). [link to article][97RuAzTs.SiH2]
  30. Garcia-Cuesta, I., Sanchez-Marin, J., Sanchez de Meras, A., Ben Amor, N., "Assessment for the mean value total dressing method: Comparison with coupled cluster including triples methods for BF, NO+, CN+, C2, BeO, NH3, CH2, H2O, BH, HF, SiH2, Li2, LiNa, LiBe+, NeH+ and O3", Journal of Chemical Physics 107, 6306-6320 (1997). [link to article][97GaSaSa.O3]
  31. Matsunaga, N., Koseki, S., Gordon, M. S., "Relativistic potential energy surfaces of XH(2) (X=C, Si, Ge, Sn, and Pb) molecules: Coupling of (1)A(1) and B-3(1) states", Journal of Chemical Physics 104, 7988-7996 (1996). [link to article][96MaKoGo.SiH2]
  32. Mineva, T., Russo, N., Sicilia, E., Toscano, M., "Spectroscopic constants of SiH2, GeH2, SnH2, and their cations and anions from density-functional computations", International Journal of Quantum Chemistry 56, 669-675 (1995). [link to article][95MiRuSi.SiH2]
  33. Ishikawa, H., Kajimoto, O., "Reanalysis of the vibrational resonances of SiH2 in the (X)Over-Tilde (1)A(1) state", Journal of Molecular Spectroscopy 174, 270-273 (1995). [link to article][95IsKaxx.SiH2]
  34. Jasinski, J. M., Becerra, R., Walsh, R., "Direct kinetic-studies of silicon hydride radicals in the gas-phase", Chemical Reviews 95, 1203-1228 (1995). [link to article][95JaBeWa.SiH2]
  35. Avery, L. W., Bell, M. B., Cunningham, C. T., Feldman, P. A., Hayward, R. H., Macleod, J. M., Matthews, H. E., Wade, J. D., "Submillimeter molecular line observations of IRC +10216: Searches for MgH, SiH2, and HCO(+), and detection of hot HCN", The Astrophysical Journal 426, 737-741 (1994). [link to article][94AvBeCu.MgH]
  36. Cramer, C. J., Dulles, F. J., Storer, J. W., Worthington, S. E., "Full valence complete active space SCF, multireference CI, and density-functional calculations of 1A1-3B1 singlet-triplet gaps for the valence-isoelectronic series BH2-, CH2, NH2+, AlH2-, SiH2, PH2+, GaH2-, GeH2, and AsH2+", Chemical Physics Letters 218, 387-394 (1994). [link to article][94CrDuSt.SiH2]
  37. Fukushima, M., Obi, K., "Rotational analysis of the SiD2 (A)Over-Tildeb-1(1)-(X)Over-Tilde(1)A(1) transition observed in a Jet", Journal of Chemical Physics 100, 6221-6227 (1994). [link to article][94FuObxx.SiH2]
  38. Watts, J. D., Bartlett, R. J., "The inclusion of connected triple excitations in the Equation-of-Motion Coupled-Cluster Mmethod", Journal of Chemical Physics 101, 3073-3078 (1994). [link to article][94WaBaxx.SiH2]
  39. Markus, M. W., Roth, P., "A quantitative ring dye-laser absorption diagnostic for free SiH2 ((X)Over-Tilde(1)A(1)) radicals at high-temperatures", Journal of Quantitative Spectroscopy and Radiative Transfer 52, 783-789 (1994). [link to article][94MaRoxx.SiH2]
  40. Mick, H. J., Roth, P., Smirnov, V. N., Zaslonko, I. S., "Formation of hydrogen-atoms in silane pyrolysis behind shock-waves - kinetics and thermochemistry of SiH4, SiH3, and SiH2 decomposition", Kinetics and Catalysis 35, 439-451 (1994).[94MiRoSm.SiH2]
  41. Gabriel, W., Rosmus, P., Yamashita, K., Morokuma, K., Palmieri, P., "Theoretical rotational vibrational-spectrum of SiH2 (X1A1 and A 3B1)", Chemical Physics 174, 45-56 (1993). [link to article][93GaRoYa.SiH2]
  42. Winter, C., Millie, P., "Theoretical study of small hydrogenated silicon compounds. I. Theoretical study of the SiH2 dissociation channels up to 8 eV excitation energy", Chemical Physics 174, 177-190 (1993). [link to article][93WiMix1.SiH]
  43. Winter, C., Millie, P., "Theoretical study of small hydrogenated silicon compounds. II. Role of the hybridization in SiHn (n=1, 2) as compared to CHn (n=1, 2)", Chemical Physics 174, 191-197 (1993). [link to article][93WiMixx.SiH]
  44. Duxbury, G., Alijah, A., Trieling, R. R., "Renner-Teller and spin-orbit interactions in SiH2", Journal of Chemical Physics 98, 811-825 (1993). [link to article][93DuAlTr.SiH2]
  45. Ishikawa, H., Kajimoto, O., "Vibrational analysis of SiH2 ((A)Tilde(1)B(1))", Journal of Molecular Spectroscopy 160, 1-10 (1993). [link to article][93IsKaxx.SiH2]
  46. Gabriel, W., Rosmus, P., "Selective mode excitations in the electronic ground-states of H2O, HDO, SiH2, and NH2", Journal of Physical Chemistry 97, 12644-12649 (1993). [link to article][93GaRoxx.SiH2]
  47. Fukushima, M., Mayama, S., Obi, K., "Jet spectroscopy and excited-state dynamics of SiH2 and SiD2", Journal of Chemical Physics 96, 44-52 (1992). [link to article][92FuMaOb.SiH2]
  48. Grev, R. S., Schaefer, H. F., "Thermochemistry of CHn, SiHn (n=0–4), and the cations SiH+, SiH2+, and SiH3+: A converged quantum mechanical approach", Journal of Chemical Physics 97, 8389-8406 (1992). [link to article][92GrScxx.SiH]
  49. McKay, R. I., Uichanco, A. S., Bradley, A. J., Holdsworth, J. R. and Francisco, J. S., Steinfeld, J. I., Knight, A. E. W., "Direct observation of silicon (3P) following state-selected photofragmentation of A 1B1 silylene", Journal of Chemical Physics 95, 1688-1695 (1991). [link to article][91McUiBr.SiH2]
  50. Ishikawa, H., Kajimoto, O., "Fermi resonance and vibrational analysis of SiH2 (A1A1) based on the LIF excitation-spectra of the A1B1 (060)]-A1A1 (0-Upsilon''0) transitions", Journal of Molecular Spectroscopy 150, 610-619 (1991). [link to article][91IsKaxx.SiH2]
  51. Yamada, C., Kanamori, H., Hirota, E., Nishiwaki, N., Itabashi, N. and Kato, K., Goto, T., "Detection of the silylene nu-2 band by infrared diode laser kinetic spectroscopy", Journal of Chemical Physics 91, 4582-4586 (1989). [link to article][89YaKaHi.SiH2]
  52. Curtiss, L. A., Pople, J. A., "Theoretical enthalpies of formation of SiHn and SiHn+ (n = 1−4)", Chemical Physics Letters 144, 38-42 (1988). [link to article][88CuPoxx.SiH]
  53. Agrawal, P. M., Thompson, D. L., Raff, L. M., "Trajectory studies of unimolecular reactions of Si2H4 and SiH2 on a global potential surface fitted to abinitio and experimental data", Journal of Chemical Physics 89, 741-750 (1988). [link to article][88AgThRa.SiH2]
  54. Francisco, J. S., Barnes, R., Thoman, J. W., "Dissociation dynamics of low-lying electronic states of SiH2", Journal of Chemical Physics 88, 2334-2341 (1988). [link to article][88FrBaTh.SiH2]
  55. Selmani, A., Salahub, D. R., "On the singlet triplet splitting in SiH2, GeH2, and SnH2. Local-spin-density calculations", Journal of Chemical Physics 89, 1529-1532 (1988). [link to article][88SeSaxx.SiH2]
  56. Vanzoeren, C. M., Thoman, J. W., Steinfeld, J. I., Rainbird, M. W., "Production of Si(1D2) from electronically excited SiH2", Journal of Physical Chemistry 92, 9-11 (1988). [link to article][88VaThSt.SiH2]
  57. Nguyen, M. T., "Calculations on the electron-affinity of silylene (SiH2)", Journal of Molecular Structure: THEOCHEM 41, 391-397 (1988). [link to article][88Nguyen.SiH2]
  58. Kalcher, J., "Ab initio and pseudopotential investigations on the SiHn (n = 1–3) radicals and their anions", Chemical Physics 118, 273-284 (1987). [link to article][87Kalcher.SiH]
  59. Bauschlicher, C. W., Langhoff, S. R., Taylor, P. R., "On the 1A1-3B1 separation in CH2 and SiH2", Journal of Chemical Physics 87, 387-391 (1987). [link to article][87BaLaTa.SiH2]
  60. Bauschlicher, C. W., Taylor, P. R., "A full CI treatment of the 1A1, 1B1, and 3B1 states of SiH2", Journal of Chemical Physics 86, 1420-1424 (1987). [link to article][87BaTaxx.SiH2]
  61. Bauschlicher, C. W., Taylor, P. R., "Full CI benchmark calculations for several states of the same symmetry", Journal of Chemical Physics 86, 2844-2848 (1987). [link to article][87BaTaxxa.SiH2]
  62. Engel, Y. M., Levine, R. D., Thoman, J. W., Steinfeld, J. I., McKay, R. I., "Quantal fluctuations in fluorescence lifetimes of individual rovibronic levels", Journal of Chemical Physics 86, 6561-6563 (1987). [link to article][87EnLeTh.SiH2]
  63. Thoman, J. W., Steinfeld, J. I., McKay, R. I., Knight, A. E. W., "Wide fluctuations in fluorescence lifetimes of individual rovibronic levels in SiH2 (A1B1)", Journal of Chemical Physics 86, 5909-5917 (1987). [link to article][87ThStMc.SiH2]
  64. Koseki, S., Gordon, M. S., "Potential-energy surfaces and dynamic properties of three low-lying states of silylene", Journal of Molecular Spectroscopy 123, 392-404 (1987). [link to article][87KoGoxx.SiH2]
  65. Bauschlicher, C. W., Taylor, P. R., "Full CI benchmark calculations for molecular-properties", Theoretica Chimica Acta 71, 263-276 (1987). [link to article][87BaTaxxb.SiH3]
  66. Allen, W. D., Schaefer, H. F., "Geometrical structures, force constants, and vibrational spectra of SiH, SiH2, SiH3, and SiH4", Chemical Physics 108, 243-274 (1986). [link to article][86AlScxx.SiH]
  67. Eley, C. D., Rowe, M. C. A., Walsh, R., "Relative rate studies for silylene", Chemical Physics Letters 126, 153-157 (1986). [link to article][86ElRoWa.SiH2]
  68. Gordon, M. S., Schmidt, M. W., "Potential triplet silylenes", Chemical Physics Letters 132, 294-298 (1986). [link to article][86GoScxx.SiH2]
  69. Obrien, J. J., Atkinson, G. H., "Detection of the SiH2 radical by intracavity laser-absorption spectroscopy", Chemical Physics Letters 130, 321-329 (1986). [link to article][86ObAtxx.SiH2]
  70. Thoman, J. W., Steinfeld, J. I., "Laser-excited fluorescence detection of SiH2 produced in IR MPD of organosilanes", Chemical Physics Letters 124, 35-38 (1986). [link to article][86ThStxx.SiH2]
  71. Balasubramanian, K., McLean, A. D., "The singlet triplet energy separation in silylene", Journal of Chemical Physics 85, 5117-5119 (1986). [link to article][86BaMcxx.SiH2]
  72. Noorbatcha, I., Raff, L. M., Thompson, D. L., Viswanathan, R., "Dynamics of unimolecular dissociation of silylene", Journal of Chemical Physics 84, 4341-4346 (1986). [link to article][86NoRaTh.SiH2]
  73. Shin, S. K., Beauchamp, J. L., "Proton affinity and heat of formation of silylene", Journal of Physical Chemistry 90, 1507-1509 (1986). [link to article][86ShBexx.SiH2]
  74. Gordon, M. S., "Potential-energy surfaces in singlet and triplet silylene", Chemical Physics Letters 114, 348-352 (1985). [link to article][85Gordon.SiH2]
  75. Fredin, L., Hauge, R. H., Kafafi, Z. H., Margrave, J. L., "Matrix-isolation studies of the reactions of silicon atoms with molecular-hydrogen. The infrared-spectrum of silylene", Journal of Chemical Physics 82, 3542-3545 (1985). [link to article][85FrHaKa.SiH2]
  76. Viswanathan, R., Thompson, D. L., Raff, L. M., "A valence-bond potential-energy surface for silylene dissociation", Journal of Physical Chemistry 89, 1428-1432 (1985). [link to article][85ViThRa.SiH]
  77. Inoue, G., Suzuki, M., "Laser-induced fluorescence of the SiH2 radical", Chemical Physics Letters 105, 641-644 (1984). [link to article][84InSuxx.SiH2]
  78. Rice, J. E., Handy, N. C., "The low-lying states of silylene", Chemical Physics Letters 107, 365-374 (1984). [link to article][84RiHaxx.SiH2]
  79. Jasinski, J. M., Whittaker, E. A., Bjorklund, G. C., Dreyfus, R. W. and Estes, R. D., Walkup, R. E., "Detection Oof SiH2 in silane and disilane glow-discharges by frequency-modulation absorption-spectroscopy", Applied Physics Letters 44, 1155-1157 (1984). [link to article][84JaWhBj.SiH2]
  80. Colvin, M. E., Grev, R. S., Schaefer, H. F., Bicerano, J., "X1A1, A3B1, and A1B1 electronic states of silylenes. Structures and vibrational frequencies of SiH2, SiHF, and SIF2", Chemical Physics Letters 99, 399-405 (1983). [link to article][83CoGrSc.SiH2]
  81. Okeefe, J. F., Lampe, F. W., "Spectroscopic detection of silylene in the infrared multiphoton decomposition of silane", Applied Physics Letters 42, 217-219 (1983). [link to article][83OkLaxx.SiH2]
  82. Ball, J. R., Thomson, C., "Electronic-structure of SiH2, PH2, and their positive and negative-ions", International Journal of Quantum Chemistry 14, 39-53 (1978). [link to article][78BaThxx.SiH2]
  83. Heaton, M. M., "Theoretical studies of electron-affinity of SiH2", Journal of Chemical Physics 67, 5396-5398 (1977). [link to article][77Heaton.SiH2]
  84. Meadows, J. H., Schaefer, H. F., "One-configuration and 2-configuration Hartree-Fock limit pedictions for singlet-triplet separation in methylene and silylene", Journal of the American Chemical Society 98, 4383-4386 (1976). [link to article][76MeScxx.SiH2]
  85. Dubois, I., Duxbury, G., Dixon, R. N., "Renner effect in SiH2", Journal of the Chemical Society, Faraday Transactions 71, 799-806 (1975). [link to article][75DuDuDi.SiH2]
  86. Leibovici, C., Labarre, J. F., "Quantum approach of ground-state of silylene radical - Singlet or triplet", Journal de chimie physique et de physico-chimie biologique 72, 951-952 (1975). [link to article][75LeLaxx.SiH2]
  87. Zeck, O. F., Su, Y. Y., Gennaro, G. P., Tang, Y. N., "Ground electronic state of silylene", Journal of the American Chemical Society 96, 5967-5973 (1974). [link to article][74ZeSuGe.SiH2]
  88. Higuchi, J., Kubota, S., Kumamoto, T., Tokue, I., "Contribution of D orbitals in SiH SiH2, SiH3, and SiH4", Bulletin of the Chemical Society of Japan 47, 2775-2780 (1974). [link to article][74HiKuKu.SiH2]
  89. Wirsam, B., "Ab-initio potential curves for radical SiH2", Chemical Physics Letters 14, 214-216 (1972). [link to article][72Wirsam.SiH2]
  90. Dubois, I., "Absorption spectrum of free SiH2 radical", Canadian Journal of Physics 46, 2485-2490 (1968). [link to article][68Dubois.SiH2]
  91. Dubois, I., Herzberg, G., Verma, R. D., "Spectrum of SiH2", Journal of Chemical Physics 47, 4262 (1967). [link to article][67DuHeVe.SiH2]
  92. Jordan, P. C., "Lower electronic levels of radicals SiH SIH2 and SiH30", Journal of Chemical Physics 44, 3400 (1966). [link to article][66Jordan.SiH2]

The ExoMol bibliometrician is Olga Yurchenko