Year |
Citation |
Score |
2017 |
Whittaker ML, Sun W, DeRocher KA, Jayaraman S, Ceder G, Joester D. Structural Basis for Metastability in Amorphous Calcium Barium Carbonate (ACBC) Advanced Functional Materials. 28: 1704202. DOI: 10.1002/Adfm.201704202 |
0.328 |
|
2015 |
Sun W, Jayaraman S, Chen W, Persson KA, Ceder G. Nucleation of metastable aragonite CaCO3 in seawater. Proceedings of the National Academy of Sciences of the United States of America. 112: 3199-204. PMID 25739963 DOI: 10.1073/Pnas.1423898112 |
0.307 |
|
2014 |
Manga VR, Bringuier S, Paul J, Jayaraman S, Lucas P, Deymier P, Muralidharan K. Molecular dynamics simulations and thermodynamic modeling of NaCl-KCl-ZnCl2 ternary system Calphad: Computer Coupling of Phase Diagrams and Thermochemistry. 46: 176-183. DOI: 10.1016/J.Calphad.2014.04.004 |
0.383 |
|
2012 |
Verevkin SP, Zaitsau DH, Emel'yanenko VN, Schick C, Jayaraman S, Maginn EJ. An elegant access to formation and vaporization enthalpies of ionic liquids by indirect DSC experiment and "in silico" calculations. Chemical Communications (Cambridge, England). 48: 6915-7. PMID 22674060 DOI: 10.1039/C2Cc31504A |
0.569 |
|
2012 |
Verevkin SP, Zaitsau DH, Emel'Yanenko VN, Ralys RV, Schick C, Geppert-Rybczyska M, Jayaraman S, Maginn EJ. Benchmark values: Thermochemistry of the ionic liquid [C4Py][Cl] Australian Journal of Chemistry. 65: 1487-1490. DOI: 10.1071/Ch12314 |
0.563 |
|
2012 |
Paluch AS, Jayaraman S, Shah JK, Maginn EJ. Erratum: “A method for computing the solubility limit of solids: Application to sodium chloride in water and alcohols” [J. Chem. Phys. 133, 124504 (2010)] The Journal of Chemical Physics. 137: 039901. DOI: 10.1063/1.4738193 |
0.627 |
|
2011 |
Jayaraman S, Thompson AP, von Lilienfeld OA. Molten salt eutectics from atomistic simulations. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 84: 030201. PMID 22060319 DOI: 10.1103/Physreve.84.030201 |
0.405 |
|
2010 |
Paluch AS, Jayaraman S, Shah JK, Maginn EJ. A method for computing the solubility limit of solids: application to sodium chloride in water and alcohols. The Journal of Chemical Physics. 133: 124504. PMID 20886947 DOI: 10.1063/1.3478539 |
0.64 |
|
2010 |
Jayaraman S, Thompson AP, Von Lilienfeld OA, Maginn EJ. Molecular simulation of the thermal and transport properties of three alkali nitrate salts Industrial and Engineering Chemistry Research. 49: 559-571. DOI: 10.1021/Ie9007216 |
0.612 |
|
2007 |
Jayaraman S, Maginn EJ. Computing the melting point and thermodynamic stability of the orthorhombic and monoclinic crystalline polymorphs of the ionic liquid 1-n-butyl-3-methylimidazolium chloride. The Journal of Chemical Physics. 127: 214504. PMID 18067361 DOI: 10.1063/1.2801539 |
0.566 |
|
Show low-probability matches. |