Your search returned 32 results.

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	1.	Nonadiabatic chemical dynamics in an intense laser field: electronic wave packet coupled with classical nuclear motions. [electronic resource] by Yagi, Kiyoshi Takatsuka, Kazuo Producer: 20070712 In: The Journal of chemical physics vol. 123 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Vibrational quasi-degenerate perturbation theory with optimized coordinates: applications to ethylene and trans-1,3-butadiene. [electronic resource] by Yagi, Kiyoshi Otaki, Hiroki Producer: 20141016 In: The Journal of chemical physics vol. 140 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Infrared Spectra of Protonated Water Clusters, H [electronic resource] by Yagi, Kiyoshi Thomsen, Bo Producer: 20180305 In: The journal of physical chemistry. A vol. 121 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Vibrational quasi-degenerate perturbation theory: applications to fermi resonance in CO2, H2CO, and C6H6. [electronic resource] by Yagi, Kiyoshi Hirata, So Hirao, Kimihiko Producer: 20080605 In: Physical chemistry chemical physics : PCCP vol. 10 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	First-principles theories for anharmonic lattice vibrations. [electronic resource] by Hirata, So Keçeli, Murat Yagi, Kiyoshi Producer: 20101201 In: The Journal of chemical physics vol. 133 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	Efficient configuration selection scheme for vibrational second-order perturbation theory. [electronic resource] by Yagi, Kiyoshi Hirata, So Hirao, Kimihiko Producer: 20070926 In: The Journal of chemical physics vol. 127 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	Optimized coordinates for anharmonic vibrational structure theories. [electronic resource] by Yagi, Kiyoshi Keçeli, Murat Hirata, So Producer: 20130507 In: The Journal of chemical physics vol. 137 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	First-principles calculations on anharmonic vibrational frequencies of polyethylene and polyacetylene in the Gamma approximation. [electronic resource] by Keçeli, Murat Hirata, So Yagi, Kiyoshi Producer: 20101201 In: The Journal of chemical physics vol. 133 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	Fermi resonance in solid CO2 under pressure. [electronic resource] by Sode, Olaseni Keçeli, Murat Yagi, Kiyoshi Hirata, So Producer: 20130826 In: The Journal of chemical physics vol. 138 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	Anharmonic Vibrational Analysis of Biomolecules and Solvated Molecules Using Hybrid QM/MM Computations. [electronic resource] by Yagi, Kiyoshi Yamada, Kenta Kobayashi, Chigusa Sugita, Yuji Producer: 20190326 In: Journal of chemical theory and computation vol. 15 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	Highly accurate potential-energy and dipole moment surfaces for vibrational state calculations of methane. [electronic resource] by Oyanagi, Chikako Yagi, Kiyoshi Taketsugu, Tetsuya Hirao, Kimihiko Producer: 20070810 In: The Journal of chemical physics vol. 124 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	First-principles quantum calculations on the infrared spectrum and vibrational dynamics of the guanine-cytosine base pair. [electronic resource] by Yagi, Kiyoshi Karasawa, Hideyuki Hirata, So Hirao, Kimihiko Producer: 20091013 In: Chemphyschem : a European journal of chemical physics and physical chemistry vol. 10 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	Unidirectional electronic ring current driven by a few cycle circularly polarized laser pulse: quantum model simulations for Mg-porphyrin. [electronic resource] by Barth, Ingo Manz, Jörn Shigeta, Yasuteru Yagi, Kiyoshi Producer: 20070806 In: Journal of the American Chemical Society vol. 128 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	The effect of spin-orbit coupling on fast neutral chemical reaction O(3P)+CH3-->CH3O. [electronic resource] by Yagi, Kiyoshi Takayanagi, Toshiyuki Taketsugu, Tetsuya Hirao, Kimihiko Producer: 20061220 In: The Journal of chemical physics vol. 120 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	Hydrogen-Bond Network Transformation in Water-Cluster Anions Induced by the Complex Formation with Benzene. [electronic resource] by Nakanishi, Ryuzo Sato, Takeshi Yagi, Kiyoshi Nagata, Takashi Producer: 20150922 In: The journal of physical chemistry letters vol. 3 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Fundamental peak disappears upon binding of a noble gas: a case of the vibrational spectrum of PtCO in an argon matrix. [electronic resource] by Ono, Yuriko Yagi, Kiyoshi Takayanagi, Toshiyuki Taketsugu, Tetsuya Producer: 20180205 In: Physical chemistry chemical physics : PCCP vol. 20 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	17.	Response to "Comment on 'Fermi resonance in solid CO2 under pressure'" [J. Chem. Phys. 140, 177101 (2014)]. [electronic resource] by Hirata, So Sode, Olaseni Keçeli, Murat Yagi, Kiyoshi Li, Jinjin Producer: 20150413 In: The Journal of chemical physics vol. 140 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	18.	Weight-Averaged Anharmonic Vibrational Analysis of Hydration Structures of Polyamide 6. [electronic resource] by Thomsen, Bo Kawakami, Tomonori Shigemoto, Isamu Sugita, Yuji Yagi, Kiyoshi Producer: 20180420 In: The journal of physical chemistry. B vol. 121 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	19.	On the validity of the Born-Oppenheimer separation and the accuracy of diagonal corrections in anharmonic molecular vibrations. [electronic resource] by Hirata, So Miller, Edward B Ohnishi, Yu-ya Yagi, Kiyoshi Producer: 20100107 In: The journal of physical chemistry. A vol. 113 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	20.	Extensivity of energy and electronic and vibrational structure methods for crystals. [electronic resource] by Hirata, So Keçeli, Murat Ohnishi, Yu-ya Sode, Olaseni Yagi, Kiyoshi Producer: 20120731 In: Annual review of physical chemistry vol. 63 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 32 results.