Digraphs in Chemistry: All Possible Structures and Temperature-Dependent Distribution of Water Clusters

Author(s):  
Misako Aida ◽  
Dai Akase ◽  
Hideo Doi ◽  
Tomoki Yoshida
2015 ◽  
Vol 17 (29) ◽  
pp. 19162-19172 ◽  
Author(s):  
Ren-Jie Lin ◽  
Quoc Chinh Nguyen ◽  
Yew-Soon Ong ◽  
Kaito Takahashi ◽  
Jer-Lai Kuo

In this work, we identified a large number of structurally distinct isomers of midsized deprotonated water clusters using first-principles methods.


2021 ◽  
Vol 22 (23) ◽  
pp. 12896
Author(s):  
Ferenc Kovács ◽  
Hui Yan ◽  
Heng Li ◽  
Sándor Kunsági-Máté

The hydrogen bond structure of water was examined by comparing the temperature dependent OH-stretching bands of water and aqueous NaClO4, KClO4, Na2SO4, and K2SO4 solutions. Results called attention to the role of cations on top of the importance of anions determining the emerging structure of a multi-layered system consisting single water rings or multi-ring water-clusters.


Tetrahedron ◽  
1988 ◽  
Vol 44 (24) ◽  
pp. 7373-7378 ◽  
Author(s):  
S.H.Suck Salk ◽  
C.K. Lutrus ◽  
T.S. Chen ◽  
D.E. Hagen ◽  
T. Oshiro

1998 ◽  
Vol 287 (3-4) ◽  
pp. 429-434 ◽  
Author(s):  
Ingrid M. Quintana ◽  
Wilfredo Ortiz ◽  
Gustavo E. López

Author(s):  
T.E. Pratt ◽  
R.W. Vook

(111) oriented thin monocrystalline Ni films have been prepared by vacuum evaporation and examined by transmission electron microscopy and electron diffraction. In high vacuum, at room temperature, a layer of NaCl was first evaporated onto a freshly air-cleaved muscovite substrate clamped to a copper block with attached heater and thermocouple. Then, at various substrate temperatures, with other parameters held within a narrow range, Ni was evaporated from a tungsten filament. It had been shown previously that similar procedures would yield monocrystalline films of CU, Ag, and Au.For the films examined with respect to temperature dependent effects, typical deposition parameters were: Ni film thickness, 500-800 A; Ni deposition rate, 10 A/sec.; residual pressure, 10-6 torr; NaCl film thickness, 250 A; and NaCl deposition rate, 10 A/sec. Some additional evaporations involved higher deposition rates and lower film thicknesses.Monocrystalline films were obtained with substrate temperatures above 500° C. Below 450° C, the films were polycrystalline with a strong (111) preferred orientation.


2000 ◽  
Vol 24 (6) ◽  
pp. 805-813 ◽  
Author(s):  
Gorou Horiguchi ◽  
Takuichi Fuse ◽  
Naoto Kawakami ◽  
Hiroaki Kodama ◽  
Koh Iba

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