Effective utilization of noncovalent interaction descriptor in BX3–Lewis base complexes: A determination of adduct/van der Waals complexes and reassessment of the BX3 acid strength order (English)
- New search for: Lü, R.
- New search for: Zhao, Y.
- New search for: Lin, J.
- New search for: Zhao, X.
- New search for: Lü, R.
- New search for: Zhao, Y.
- New search for: Lin, J.
- New search for: Zhao, X.
In:
CHEMICAL PHYSICS LETTERS
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636
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117-120
;
2015
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ISSN:
- Article (Journal) / Print
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Title:Effective utilization of noncovalent interaction descriptor in BX3–Lewis base complexes: A determination of adduct/van der Waals complexes and reassessment of the BX3 acid strength order
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Contributors:
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Published in:CHEMICAL PHYSICS LETTERS ; 636 ; 117-120
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Publisher:
- New search for: Elsevier Science B.V., Amsterdam.
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Publication date:2015-01-01
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Size:4 pages
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ISSN:
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 530 / 540
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© Metadata Copyright the British Library Board and other contributors. All rights reserved.
Table of contents – Volume 636
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 1
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Determination of the collisional energy transfer distribution responsible for the collision-induced dissociation of NO2 with ArSteill, Jeffrey D. / Jasper, Ahren W. / Chandler, David W. et al. | 2015
- 15
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Nonadiabatic photodynamics of phenol on a realistic potential energy surface by a novel multilayer Gaussian MCTDH programSkouteris, D. / Barone, V. et al. | 2015
- 22
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One-dimensional CdWO4:Tb3+ nanofibers: Electrospinning fabrication and luminescenceLi, Bo / Zhang, He / Lan, Anyi / Tang, Hongxia et al. | 2015
- 26
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Optical and fluorescence properties of MgO nanoparticles in micellar solution of hydroxyethyl laurdimonium chlorideSalem, Jamil K. / El-Nahhal, Issa M. / Hammad, Talaat M. / Kuhn, Sylvia / Sharekh, Somaya Abu / El-Askalani, Mohamad / Hempelmann, Rolf et al. | 2015
- 31
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A theoretical study of substituted indeno[1,2-b]fluorene compounds and their possible applications in solar cellsMartinez, Ivan / Zarate, Ximena / Schott, Eduardo / Morales-Verdejo, Cesar / Castillo, Francisco / Manríquez, Juan Manuel / Chávez, Ivonne et al. | 2015
- 35
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Significance of critical photon density in the multi-photon process in laser desorption ionization using ultra-high resolution FT-ICR MSBaek, Sun J. / Kim, Jeongkwon / Kim, Hyun S. et al. | 2015
- 39
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Solvent effects to compute UV–vis spectra for ionic metal complexesBoumendil, Sonia / Cornard, Jean-Paul / Sekkal-Rahal, Majda / Moncomble, Aurélien et al. | 2015
- 46
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Visualization of the four-component g-tensor density as a three-dimensional functionAsher, James R. / Malkin, Vladimir G. / Malkina, Olga L. et al. | 2015
- 51
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H2S and NH3 adsorption characteristics on CoO nanowire molecular device – A first-principles studySriram, S. / Nagarajan, V. / Chandiramouli, R. et al. | 2015
- 58
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Raman study on a bulk-heterojunction film of pentacene and C60Iwasawa, Yasuhiro / Furukawa, Yukio et al. | 2015
- 62
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Encapsulated β-carotene in ZnO nanotubes: Theoretical insight into the stabilization dynamicsMonteiro, Fábio Ferreira / Azevedo, David Lima / da Silva, Eder Carlos / Ribeiro, Luiz Antonio Jr. / de Almeida Fonseca, Antonio Luciano et al. | 2015
- 67
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Rotationally inelastic collisions of fulminic acid (HCNO) by He atom at low temperatureNaindouba, A. / Nkem, C. / Ajili, Y. / Hammami, K. / Gotoum, N. / Owono Owono, L.C. et al. | 2015
- 72
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Enantio sensing property of helicin, the derivative of a natural product: Discrimination of amines and amino alcoholsKumari, Divya / Sachin, S.L. / Suryaprakash, N. et al. | 2015
- 78
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Electroless deposition of Ag through-void arrays for integrated extraordinary optical transmission-based plasmonic sensing and surface-enhanced Raman scatteringXu, Die / Chen, Shu / Li, Huanhuan / Yang, Zhilin / Hu, Jiawen et al. | 2015
- 84
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Effect of molecular diameters on state-to-state transport properties: The shear viscosity coefficientKustova, Elena V. / Kremer, Gilberto M. et al. | 2015
- 90
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Third-order density-functional tight-binding combined with the fragment molecular orbital methodNishimoto, Yoshio / Fedorov, Dmitri G. / Irle, Stephan et al. | 2015
- 97
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Micro-hydration and acid dissociation mechanism of B(OH)3Zhou, Yongquan / Fang, Yan / Fang, Chunhui / Zhu, Fayan / Ge, Haiwen / Liu, Hongyan et al. | 2015
- 103
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NH3 and PH3 adsorption through single walled ZnS nanotube: First principle insightKhan, Md. Shahzad / Srivastava, Anurag / Chaurasiya, Rajneesh / Khan, Mohd. Shahid / Dua, Piyush et al. | 2015
- 110
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Ab initio molecular dynamics simulation of ethanol decomposition on platinum cluster at initial stage of carbon nanotube growthShibuta, Yasushi / Shimamura, Kohei / Arifin, Rizal / Shimojo, Fuyuki et al. | 2015
- 117
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Effective utilization of noncovalent interaction descriptor in BX3–Lewis base complexes: A determination of adduct/van der Waals complexes and reassessment of the BX3 acid strength orderLü, Renqing / Zhao, Yuxin / Lin, Jin / Zhao, Xin et al. | 2015
- 121
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Spectral signatures of semiconductor clusters: (CdSe)16 isomersGutsev, L.G. / Dalal, N.S. / Ramachandran, B.R. / Weatherford, C.A. / Gutsev, G.L. et al. | 2015
- 129
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Pore-size dependent effects on structure and vibrations of 1-ethyl-3-methylimidazolium tetrafluoroborate in nanoporous carbonThürmer, Stephan / Kobayashi, Yoshikazu / Ohba, Tomonori / Kanoh, Hirofumi et al. | 2015
- 134
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Efficient photon capturing in Cu(In,Ga)Se2 thin film solar cells with ZnO nanorod arrays as an antireflective coatingBai, Anqi / Tang, Yang / Chen, Jie et al. | 2015
- 141
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Strong blue absorption of green Zn2SiO4:Mn2+ phosphor by doping heavy Mn2+ concentrationsPark, K.W. / Lim, H.S. / Park, S.W. / Deressa, G. / Kim, J.S. et al. | 2015
- 146
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Measurement and prediction of the NEXAFS spectra of pyrimidine and purine and the dissociation following the core excitationLin, Yi-Shiue / Lin, Huei-Ru / Liu, Wei-Lun / Lee, Yuan T. / Tseng, Chien-Ming / Ni, Chi-Kung / Liu, Chen-Lin / Tsai, Cheng-Cheng / Chen, Jien-Lian / Hu, Wei-Ping et al. | 2015
- 154
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A theoretical study of a homologous series of zinc n-alkanoates (2 ≤ nC ≤ 8): Structural analysis, evaluation of their interactions and monofilm formationTavares, Sérgio R. / Wypych, Fernando / Leitão, Alexandre A. et al. | 2015
- 163
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Interaction of metallic clusters with biologically active curcumin moleculesGupta, Sanjeev K. / He, Haiying / Liu, Chunhui / Dutta, Ranu / Pandey, Ravindra et al. | 2015
- 167
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Investigation of structural and dynamical properties of hafnium(IV) ion in liquid ammonia: An ab initio QM/MM molecular dynamics simulationSuwardi / Pranowo, Harno Dwi / Armunanto, Ria et al. | 2015
- 172
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QM/MM study of the S2 to S3 transition reaction in the oxygen-evolving complex of photosystem IIShoji, Mitsuo / Isobe, Hiroshi / Yamaguchi, Kizashi et al. | 2015
- 180
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Comparative ligational, optical band gap and biological studies on Cr(III) and Fe(III) complexes of hydrazones derived from 2-hydrazinyl-2-oxo-N-phenylacetamide with both vanillin and O-vanillinYousef, T.A. / Abu El-Reash, G.M. / Attia, M.I. / El-Tabai, M.N. et al. | 2015
- 193
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Buckled nanorod – The dynamics of a two state system treated with an exact HamiltonianDehning, Jonas / Chakraborty, Aniruddha et al. | 2015
- 197
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D-Dimensional relativistic energies for silver dimerSun, Yu / Zhang, Guang-Dong / Jia, Chun-Sheng et al. | 2015
- 203
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Non-Faraday rotation of the free induction decay in gaseous NOChesnokov, E.N. / Kubarev, V.V. / Koshlyakov, P.V. / Getmanov, Y.V. / Shevchenko, O.A. et al. | 2015
- 208
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Synthesis, growth, vibrational spectral investigations and structure–property relationship of an organic NLO crystal: 3,4-Dimethoxy chalconeAlen, S. / Sajan, D. / Joseph, Lynnette / Chaitanya, K. / Shettigar, Venkataraya / Jothy, V. Bena et al. | 2015
- 216
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Self-assembled biomimetic nanoreactors I: Polymeric templateMcTaggart, Matt / Malardier-Jugroot, Cecile / Jugroot, Manish et al. | 2015
- 221
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Self-assembled biomimetic nanoreactors II: Noble metal active centersMcTaggart, Matt / Malardier-Jugroot, Cecile / Jugroot, Manish et al. | 2015
- 228
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Corrigendum to “Systematic comparison of DFT and CCSD dipole moments, polarizabilities and hyperpolarizabilities” [Chem. Phys. Lett. 635 (2015) 168–173]Karne, Anagha S. / Vaval, Nayana / Pal, Sourav / Vásquez-Pérez, José M. / Köster, Andreas M. / Calaminici, Patrizia et al. | 2015
- 229
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Corrigendum to “An implementation of the Levenberg–Marquardt algorithm for simultaneous-energy-gradient fitting using two-layer feed-forward neural networks” [Chem. Phys. Lett. 629 (2015) 40–45]Nguyen-Truong, Hieu T. / Le, Hung M. et al. | 2015
- IFC
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Editorial Board| 2015
- iii
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Contents| 2015
- xiii
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Publisher's note| 2015