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	1.	Mechanism of densification in silica glass under pressure as revealed by a bottom-up pairwise effective interaction model. [electronic resource] by Izvekov, Sergei Rice, Betsy M Producer: 20120921 In: The Journal of chemical physics vol. 136 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Multi-scale coarse-graining of non-conservative interactions in molecular liquids. [electronic resource] by Izvekov, Sergei Rice, Betsy M Producer: 20141121 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.	Free-energy based pair-additive potentials for bulk Ni-Al systems: application to study Ni-Al reactive alloying. [electronic resource] by Izvekov, Sergei Rice, Betsy M Producer: 20130211 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)
	4.	A new parameter-free soft-core potential for silica and its application to simulation of silica anomalies. [electronic resource] by Izvekov, Sergei Rice, Betsy M Producer: 20160505 In: The Journal of chemical physics vol. 143 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	On the importance of shear dissipative forces in coarse-grained dynamics of molecular liquids. [electronic resource] by Izvekov, Sergei Rice, Betsy M Producer: 20150910 In: Physical chemistry chemical physics : PCCP vol. 17 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	A molecular dynamics study of the role of relative melting temperatures in reactive Ni/Al nanolaminates. [electronic resource] by Weingarten, N Scott Rice, Betsy M Producer: 20111018 In: Journal of physics. Condensed matter : an Institute of Physics journal vol. 23 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	Molecular simulation of shocked materials using the reactive Monte Carlo method. [electronic resource] by Brennan, John K Rice, Betsy M Producer: 20021217 In: Physical review. E, Statistical, nonlinear, and soft matter physics vol. 66 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	Transferable Reactive Force Fields: Extensions of ReaxFF-lg to Nitromethane. [electronic resource] by Larentzos, James P Rice, Betsy M 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)
	9.	Improved prediction of heats of formation of energetic materials using quantum mechanical calculations. [electronic resource] by Byrd, Edward F C Rice, Betsy M Producer: 20070625 In: The journal of physical chemistry. A vol. 110 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	Predicting structure of molecular crystals from first principles. [electronic resource] by Podeszwa, Rafał Rice, Betsy M Szalewicz, Krzysztof Producer: 20081218 In: Physical review letters vol. 101 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	Crystal structure prediction for cyclotrimethylene trinitramine (RDX) from first principles. [electronic resource] by Podeszwa, Rafal Rice, Betsy M Szalewicz, Krzysztof Producer: 20090917 In: Physical chemistry chemical physics : PCCP vol. 11 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	A comparison of methods to predict solid phase heats of formation of molecular energetic salts. [electronic resource] by Byrd, Edward F C Rice, Betsy M Producer: 20090219 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)
	13.	Evaluation of electrostatic descriptors for predicting crystalline density. [electronic resource] by Rice, Betsy M Byrd, Edward F C Producer: 20140225 In: Journal of computational chemistry vol. 34 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	Theoretical Study of Shocked Formic Acid: Born-Oppenheimer MD Calculations of the Shock Hugoniot and Early-Stage Chemistry. [electronic resource] by Rice, Betsy M Byrd, Edward F C Producer: 20160708 In: The journal of physical chemistry. B vol. 120 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	Particle-based multiscale coarse graining with density-dependent potentials: application to molecular crystals (hexahydro-1,3,5-trinitro-s-triazine). [electronic resource] by Izvekov, Sergei Chung, Peter W Rice, Betsy M Producer: 20111115 In: The Journal of chemical physics vol. 135 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Molecular dynamics simulations of the melting mechanisms of perfect and imperfect crystals of dimethylnitramine. [electronic resource] by Zheng, Lianqing Rice, Betsy M Thompson, Donald L Producer: 20070515 In: The journal of physical chemistry. B vol. 111 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	17.	The multiscale coarse-graining method: assessing its accuracy and introducing density dependent coarse-grain potentials. [electronic resource] by Izvekov, Sergei Chung, Peter W Rice, Betsy M Producer: 20101227 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)
	18.	Potential energy surface for cyclotrimethylene trinitramine dimer from symmetry-adapted perturbation theory. [electronic resource] by Podeszwa, Rafał Bukowski, Robert Rice, Betsy M Szalewicz, Krzysztof Producer: 20080229 In: Physical chemistry chemical physics : PCCP vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	19.	New form of polymeric nitrogen from dynamic shock simulation. [electronic resource] by Beaudet, Todd D Mattson, William D Rice, Betsy M Producer: 20130801 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)
	20.	Assessment of dispersion corrected atom centered pseudopotentials: application to energetic molecular crystals. [electronic resource] by Balu, Radhakrishnan Byrd, Edward F C Rice, Betsy M Producer: 20110523 In: The journal of physical chemistry. B vol. 115 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 31 results.