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	38381.	High-level ab initio calculations for the four low-lying families of minima of (H2O)20. II. Spectroscopic signatures of the dodecahedron, fused cubes, face-sharing pentagonal prisms, and edge-sharing pentagonal prisms hydrogen bonding networks. [electronic resource] by Fanourgakis, George S Aprà, Edoardo de Jong, Wibe A Xantheas, Sotiris S Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38382.	Protonated water clusters described by an empirical valence bond potential. [electronic resource] by James, Tim Wales, David J Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38383.	Internal dynamics features in the free jet rotational spectrum of the acetaldehyde-Kr molecular complex. [electronic resource] by Melandri, S Favero, P G Caminati, W Velino, B Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38384.	Potential energy surface for the CCl4 + H --> CCl3 + ClH reaction: kinetics and dynamics study. [electronic resource] by Rangel, C Espinosa-García, J Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38385.	Evolution of the structure of amorphous ice: from low-density amorphous through high-density amorphous to very high-density amorphous ice. [electronic resource] by Martonák, R Donadio, D Parrinello, M Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38386.	A new lattice-based theory for hydrogen-bonding liquids in uniform electric fields. [electronic resource] by Suresh, S J Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38387.	Effect of chemical structure on the isobaric and isochoric fragility in polychlorinated biphenyls. [electronic resource] by Roland, C M Casalini, R Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38388.	Solvation free energies of amino acid side chain analogs for common molecular mechanics water models. [electronic resource] by Shirts, Michael R Pande, Vijay S Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38389.	Selective internal manipulation of a single molecule by scanning tunneling microscopy. [electronic resource] by Soukiassian, Laetitia Mayne, Andrew J Comtet, Geneviève Hellner, Lucette Dujardin, Gérald Gourdon, André Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38390.	Quantitative measure of nanoscale adhesion hysteresis by ultrasonic force microscopy. [electronic resource] by Szoszkiewicz, R Kulik, A J Gremaud, G Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38391.	Targeted molecular dynamics of an open-state KcsA channel. [electronic resource] by Compoint, Mylène Picaud, Fabien Ramseyer, Christophe Girardet, Claude Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38392.	A temperature-programmed time-of-flight secondary ion mass spectroscopy study of intermixing of amorphous ethanol and heavy-water films at 15-200 K. [electronic resource] by Souda, Ryutaro Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38393.	Molecular dynamics simulations of polymer transport in nanocomposites. [electronic resource] by Desai, Tapan Keblinski, Pawel Kumar, Sanat K Producer: 20060517 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38394.	Plane wave/pseudopotential implementation of excited state gradients in density functional linear response theory: a new route via implicit differentiation. [electronic resource] by Doltsinis, Nikos L Kosov, D S Producer: 20060608 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38395.	Electron density distribution in stacked benzene dimers: a new approach towards the estimation of stacking interaction energies. [electronic resource] by Zhikol, Oleg A Shishkin, Oleg V Lyssenko, Konstantin A Leszczynski, Jerzy Producer: 20060608 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38396.	Comparison of efficiency and bias of free energies computed by exponential averaging, the Bennett acceptance ratio, and thermodynamic integration. [electronic resource] by Shirts, Michael R Pande, Vijay S Producer: 20060608 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38397.	Vibrational dependence of the H2-H2 C6 dispersion coefficients. [electronic resource] by Hinde, Robert J Producer: 20060608 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38398.	An ab initio study of the vibronic, spin-orbit, and magnetic hyperfine structure in the X2Pi electronic state of NCO. [electronic resource] by Mladenović, Milena Perić, Miljenko Engels, Bernd Producer: 20060608 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38399.	Complete valence double photoionization of SF6. [electronic resource] by Feifel, R Eland, J H D Storchi, L Tarantelli, F Producer: 20060608 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	38400.	Ab initio dipole polarizability surfaces of water molecule: static and dynamic at 514.5 nm. [electronic resource] by Avila, G Producer: 20060608 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)

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Your search returned 47285 results.