ViewVC Help
View File | Revision Log | Show Annotations | View Changeset | Root Listing
root/group/trunk/iceiPaper/iceiPaper.bib
(Generate patch)

Comparing trunk/iceiPaper/iceiPaper.bib (file contents):
Revision 1453 by chrisfen, Mon Sep 13 18:39:53 2004 UTC vs.
Revision 1471 by chrisfen, Fri Sep 17 06:47:18 2004 UTC

# Line 14 | Line 14
14   @string{mp = "Mol. Phys."}
15   @string{pnas = "Proc. Natl. Acad. Sci. USA"}
16   @string{jacs = "J. Am. Chem. Soc."}
17 + @string{jcc = "J. Comput. Chem."}
18 + @string{pccp = "Phys. Chem. Chem. Phys."}
19  
20   @Book{Berne90,
21    author =       {B.~J. Berne and R. Pecora},
# Line 1515 | Line 1517 | on Foundations of Computer Science},
1517    pages =        {8638-8639}
1518   }
1519  
1520 < @Article{liu96:new_model,
1520 > @Article{Liu96,
1521    author =       {Y. Liu and T. Ichiye},
1522    title =        {Soft sticky dipole potential for liquid water: a new model},
1523    journal =      jpc,
# Line 1735 | Line 1737 | on Foundations of Computer Science},
1737    pages =        {1461-1462}
1738   }
1739  
1740 < @Article{Ichiye03,
1740 > @Article{Tan03,
1741    author =       {M.-L. Tan and J.~T. Fischer and A. Chandra and B.~R. Brooks
1742                    and T. Ichiye},
1743    title =        {A temperature of maximum density in soft sticky dipole
# Line 2052 | Line 2054 | $\mbox{Cu, Ag, Au, Ni, Pd, Pt}$, and their alloys},
2054  
2055  
2056  
2057 < @Article{fennell04,
2057 > @Article{Fennell04,
2058    author =       {C.~J. Fennell and J.~D. Gezelter},
2059    title =        {On the structural and transport properties of the soft sticky dipole(SSD) and related single point water models},
2060    journal =      jcp,
# Line 2223 | Line 2225 | $\mbox{Cu, Ag, Au, Ni, Pd, Pt}$, and their alloys},
2225    volume =       112,
2226    number =       20,
2227    pages =        {8910-8922}
2228 + }
2229 +
2230 +
2231 + @Article{Meineke05,
2232 +  author =       {M.~A. Meineke and C.~F. Vardeman~II and T. Lin and C.~J. Fennell and J.~D. Gezelter},
2233 +  title =        {OOPSE: An Open Source Object-Oriented Parallel Simulation Engine for Molecular Dynamics},
2234 +  journal =      {J. Comp. Chem.},
2235 +  year =         {in press 2005}
2236   }
2237  
2238 + @Article{Baez95a,
2239 +  author =       {L.~A. B\`{a}ez and P. Clancy},
2240 +  title =        {Calculation of free energy for molecular crystals by thermodynamic integration},
2241 +  journal =      mp,
2242 +  year =         1995,
2243 +  volume =       86,
2244 +  number =       3,
2245 +  pages =        {385-396}
2246 + }
2247 +
2248 + @Article{Baez95b,
2249 +  author =       {L.~A. B\`{a}ez and P. Clancy},
2250 +  title =        {Phase equilibria in extended simple point charge ice-water systems},
2251 +  journal =      jcp,
2252 +  year =         1995,
2253 +  volume =       103,
2254 +  number =       22,
2255 +  pages =        {9744-9755}
2256 + }
2257 +
2258 + @Article{Davidson84,
2259 +  author =       {E.~R. Davidson and K. Morokuma},
2260 +  title =        {A proposed antiferroelectric structure for proton ordered ice Ih},
2261 +  journal =      jcp,
2262 +  year =         1984,
2263 +  volume =       81,
2264 +  number =       8,
2265 +  pages =        {3741-3742}
2266 + }
2267 +
2268 + @Article{Sanz04,
2269 +  author =       {E. Sanz and C. Vega and J.~L.~F. Abascal and L.~G. MacDowell},
2270 +  title =        {Phase Diagram of Water from Computer Simulation},
2271 +  journal =      prl,
2272 +  year =         2004,
2273 +  volume =       92,
2274 +  number =       25,
2275 +  pages =        255701
2276 + }
2277 +
2278 + @Article{Onsager36,
2279 +  author =       {L. Onsager},
2280 +  title =        {Electric Moments of Molecules in Liquids},
2281 +  journal =      jacs,
2282 +  year =         1936,
2283 +  volume =       58,
2284 +  pages =        {1486-1493}
2285 + }
2286 +
2287 + @Article{Matsumoto02,
2288 +  author =       {M. Matsumoto and S. Saito and I. Ohimine},
2289 +  title =        {Molecular dynamics simulation of the ice nucleation and growth process leading to water freezing},
2290 +  journal =      {Nature (London)},
2291 +  year =         2002,
2292 +  volume =       416,
2293 +  pages =        {409-413},
2294 + }
2295 +
2296 + @Article{Yamada02,
2297 +  author =       {M. Yamada and S. Mossa and H.~E. Stanley and F. Sciortino},
2298 +  title =        {Interplay between Time-Temperature Transformation and the Liquid-Liquid Phase Transition in Water},
2299 +  journal =      prl,
2300 +  year =         2002,
2301 +  volume =       88,
2302 +  number =       19,
2303 +  pages =        195701,
2304 + }
2305 +
2306 + @Article{Wallqvist95,
2307 +  author =       {A. Wallqvist and B.~J. Berne},
2308 +  title =        {Molecular Dynamics Study of the Dependence of Water Solvation Free Energy on Solute Curvature and Surface Area},
2309 +  journal =      jpc,
2310 +  year =         1995,
2311 +  volume =       99,
2312 +  pages =        {2885-2892}
2313 + }
2314 +
2315 + @Article{Vlot99,
2316 +  author =       {M.~J. Vlot and J. Huinink and J.~P. van~der~Eerden},
2317 +  title =        {Free energy calculations on systems of rigid molecules: An application to the TIP4P model of H$_2$O},
2318 +  journal =      jcp,
2319 +  year =         1999,
2320 +  volume =       110,
2321 +  number =       1,
2322 +  pages =        {55-61}
2323 + }
2324 +
2325 + @Article{Gao00,
2326 +  author =       {G.~T. Gao and X.~C. Zeng and H. Tanaka},
2327 +  title =        {The melting temperature of proton-disordered hexagonal ice: A computer simulation of 4-site transferable intermolecular potential model of water},
2328 +  journal =      jcp,
2329 +  year =         2000,
2330 +  volume =       112,
2331 +  number =       19,
2332 +  pages =        {8534-8538}
2333 + }
2334 +
2335 + @Article{Bizid87,
2336 +  author =       {A. Bizid and L. Bosio and A. Defrain and M. Oumezzine},
2337 +  title =        {Structure of high-density amorphous water. I. X-ray diffraction study},
2338 +  journal =      jcp,
2339 +  year =         1987,
2340 +  volume =       87,
2341 +  number =       4,
2342 +  pages =        {2225-2230}
2343 + }
2344 +
2345 + @Article{Quintana92,
2346 +  author =       {J. Quintana and A.~D.~J. Haymet},
2347 +  title =        {The chemical potential of water: molecular dynamics computer simulation of the CF and SPC models},
2348 +  journal =      cpl,
2349 +  year =         1992,
2350 +  volume =       189,
2351 +  number =       3,
2352 +  pages =        {273-277}
2353 + }
2354 +
2355 +
2356 + @Article{Mezei92,
2357 +  author =       {M. Mezei},
2358 +  title =        {Don't Remember},
2359 +  journal =      {J. Comput. Chem.},
2360 +  year =         1992,
2361 +  volume =       13,
2362 +  pages =        651
2363 + }
2364 +
2365 +
2366 + @Article{Widom63,
2367 +  author =       {B. Widom},
2368 +  title =        {Particle insertion},
2369 +  journal =      jcp,
2370 +  year =         1963,
2371 +  volume =       39,
2372 +  pages =        2808
2373 + }
2374 +
2375 + @Article{Clancy94,
2376 +  author =       {L.~A. B\'{a}ez and P. Clancy},
2377 +  title =        {Existence of a density maximum in extended simple point
2378 +                  charge water},
2379 +  journal =      jcp,
2380 +  year =         1994,
2381 +  volume =       101,
2382 +  number =       11,
2383 +  pages =        {9837-9840}
2384 + }
2385 +
2386 + @Article{Jorgensen98b,
2387 +  author =       {W.~L. Jorgensen and C. Jenson},
2388 +  title =        {Temperature Dependence of TIP3P, SPC, and TIP4P Water
2389 +                  from NPT Monte Carlo Simulations: Seeking Temperatures
2390 +                  of Maximum Density},
2391 +  journal =      jcc,
2392 +  year =         1998,
2393 +  volume =       19,
2394 +  number =       10,
2395 +  pages =        {1179-1186}
2396 + }
2397 +
2398 + @Article{Mahoney01,
2399 +  author =       {M.~W. Mahoney and W.~L. Jorgensen},
2400 +  title =        {Diffusion constant of the TIP5P model of liquid water},
2401 +  journal =      jcp,
2402 +  year =         2001,
2403 +  volume =       114,
2404 +  number =       1,
2405 +  pages =        {363-366},
2406 + }
2407 +
2408 + @Article{Rahman75,
2409 +  author =       {A. Rahman and F.~H. Stillinger and H.~L. Lemberg},
2410 +  title =        {Study of a central force model for liquid water by
2411 +                  molecular dynamics},
2412 +  journal =      jcp,
2413 +  year =         1975,
2414 +  volume =       63,
2415 +  number =       12,
2416 +  pages =        {5223-5230}
2417 + }
2418 +
2419 + @Article{Berendsen98,
2420 +  author =       {D. van der Spoel and P.~J. van Maaren and H.~J.~C. Berendsen},
2421 +  title =        {A systematc study of water models for molecular
2422 +                  simulation: Derivation of water models optimized for
2423 +                  use with a reaction field},
2424 +  journal =      jcp,
2425 +  year =         1998,
2426 +  volume =       108,
2427 +  number =       24,
2428 +  pages =        {10220-10230}
2429 + }
2430 +
2431 + @Article{Gallagher03,
2432 +  author =       {K.~R. Gallagher and K.~A. Sharp},
2433 +  title =        {A New Angle on Heat Capacity Changes in Hydrophobic Solvation},
2434 +  journal =      jacs,
2435 +  year =         2003,
2436 +  volume =       125,
2437 +  pages =        9853
2438 + }
2439 +
2440 + @Article{Frenkel84,
2441 +  author =       {D. Frenkel and A.~J.~C. Ladd},
2442 +  title =        {New Monte Carlo method to compute the free energy of arbitrary solids. Application to the fcc and hcp phases of hard spheres},
2443 +  journal =      jcp,
2444 +  year =         1984,
2445 +  volume =       81,
2446 +  number =       7,
2447 +  pages =        {3188-3193}
2448 + }
2449 +
2450 + @Article{Hermens88,
2451 +  author =       {J. Hermans and A. Pathiaseril and A. Anderson},
2452 +  title =        {Excess Free Energy of Liquids from Molecular Dynamics Simulations. Application to Water Models},
2453 +  journal =      jacs,
2454 +  year =         1988,
2455 +  volume =       110,
2456 +  pages =        {5982-5986}
2457 + }
2458 +
2459 + @Article{Meijer90,
2460 +  author =       {E.~J. Meijer and D. Frenkel and R.~A. LeSar and A.~J.~C. Ladd},
2461 +  title =        {Location of melting point at 300 K of nitrogen by Monte Carlo simulation},
2462 +  journal =      jcp,
2463 +  year =         1990,
2464 +  volume =       92,
2465 +  number =       12,
2466 +  pages =        {7570-7575}
2467 + }
2468 +

Diff Legend

Removed lines
+ Added lines
< Changed lines
> Changed lines