E. Tsivion and M. Head-Gordon
The Journal of Physical Chemistry C, 2017
Methane Storage: Molecular Mechanisms Underlying Room-Temperature adsorption in
Zn4O(BDC)3 (MOF-5)
High Temperature Hydrogen Storage of Multiple molecules: Theoretical Insights from
Metalated Catechols
E. Tsivion, R. P. Veccham and M. Head-Gordon
ChemPhysChem, 2017
A
computational study of CH4 storage in porous framework materials with
metalated linkers: connecting the atomistic character of CH4 binding sites to
usable capacity
E. Tsivion, J. A. Mason, M. I. Gonzalez, J. R. Long, and M. Head-Gordon
Chemical Science, 2016
Hetero-bimetallic metal–organic polyhedra
J. M. Teo, C. J. Coghlan, J. D. Evans, E. Tsivion, M. Head-Gordon, C. J. Sumby, and
C. J. Doonan
Chemical Communications, 2015
Critical Factors Driving the High Volumetric Uptake of Methane in Cu3(btc)2
Z. Hulvey, B. Vlaisavljevich, J. A. Mason, E. Tsivion, T. P. Dougherty, E. D. Bloch,
M. Head-Gordon, B. Smit, J. R. Long, and C. M. Brown
Journal of the American Chemical Society, 2015
Hydrogen Physisorption on Metal–
Organic Framework Linkers and Metalated Linkers: A Computational Study of the
Factors That Control Binding Strength
E. Tsivion, J. R. Long, and M. Head-Gordon
Journal of the American Chemical Society, 2014
Destabilization of noble-gas hydrides
by a water environment: calculations for HXeOH@(H2O)n, HXeOXeH@(H2O)n,
HXeBr@(H2O)n, HXeCCH@(H2O)n
E. Tsivion, M. Räsänen, and R. B. Gerber
Physical Chemistry Chemical Physics, 2013
Intrinsic lifetimes and kinetic stability in media of noble-gas hydride
R. B. Gerber, E. Tsivion, L. Khriachtchev, and M. Räsänen
Chemical Physics Letters, 2012
Stability of noble-gas hydrocarbons in an organic
liquid-like environment: HXeCCH in acetylene
E. Tsivion and R. B. Gerber
Physical Chemistry Chemical Physics, 2011
Predicted compounds of radon with acetylene and
water
E. Tsivion and R. B. Gerber
Physical Chemistry Chemical Physics, 2010
Lifetimes of compounds made of noble-gas atoms
with water
E. Tsivion and R. B. Gerber
Chemical Physics Letters, 2009
Direct visualization of the H--Xe bond in xenon hydrides: Xenon isotopic shift in the IR spectra
V. I. Feldman, A. V. Kobzarenko, I. A. Baranova, A. V. Danchenko, F. F. Sukhov,
E. Tsivion, and R. B. Gerber
Journal of Chemical Physics, 2009
Matrix-isolation and ab initio study of HXeCCH
complexed with acetylene
A. Domanskaya, A. V. Kobzarenko, E. Tsivion, L. Khriachtchev, V. I. Feldman, R.
Benny Gerber, and M. Räsänen
Chemical Physics Letters, 2009
Properties of Stable Organic Bond-Stretched Non-Lewis Molecules
S. Zilberg, E. Tsivion, and Y. Haas
Journal of Physical Chemistry A, 2008
Predicted stability of the organo-xenon compound HXeCCH above the cryogenic range
E. Tsivion, S. Zilberg, and R. Benny Gerber
Chemical Physics Letters, 2008