User contributions for Carl McBride

16:0116:01, 2 March 2007 diff hist 0‎ Main Page ‎No edit summary
15:5915:59, 2 March 2007 diff hist +150‎ RANLUX ‎No edit summary
15:5715:57, 2 March 2007 diff hist +439‎ N RANLUX ‎ New page: ==References== #[http://dx.doi.org/10.1016/0010-4655(94)90233-X F. James "RANLUX: A Fortran implementation of the high-quality pseudorandom number generator of Lüscher", Computer Physic...
15:3915:39, 2 March 2007 diff hist +503‎ N CASTEP ‎ New page: [http://www.tcm.phy.cam.ac.uk/castep/ CASTEP] is a software package which uses density functional theory to provide a good atomic-level description of all manner of materials and molecules...
15:3815:38, 2 March 2007 diff hist +40‎ Materials modelling and computer simulation codes ‎ →‎C
15:3515:35, 2 March 2007 diff hist +315‎ N Moldy ‎ New page: [http://www.earth.ox.ac.uk/~keithr/moldy.html Moldy] is a general-purpose molecular dynamics simulation program. It is sufficiently flexible that it ought to be useful for a wide range of...
15:3415:34, 2 March 2007 diff hist +68‎ Materials modelling and computer simulation codes ‎ →‎M
15:2615:26, 2 March 2007 diff hist +252‎ Prime modulus multiplicative linear congruential generator ‎ →‎References
15:2315:23, 2 March 2007 diff hist +200‎ Prime modulus multiplicative linear congruential generator ‎ →‎References
15:1915:19, 2 March 2007 diff hist +156‎ Prime modulus multiplicative linear congruential generator ‎ →‎References
15:1415:14, 2 March 2007 diff hist +129‎ Prime modulus multiplicative linear congruential generator ‎ →‎References
15:0615:06, 2 March 2007 diff hist +373‎ Prime modulus multiplicative linear congruential generator ‎ →‎References
12:5712:57, 2 March 2007 diff hist +95‎ Conferences ‎No edit summary

14:0514:05, 28 February 2007 diff hist +1,119‎ N SklogWiki:Copyrights ‎ New page: '''Important note:''' == Contributors' rights and obligations == If you contribute material to SklogWiki, you thereby license it to the public under the [http://www.gnu.org/copyleft/fdl....
13:1913:19, 28 February 2007 diff hist +100‎ Soft-core mean spherical approximation ‎No edit summary
13:1813:18, 28 February 2007 diff hist +349‎ Soft-core mean spherical approximation ‎No edit summary
13:1413:14, 28 February 2007 diff hist +226‎ Soft-core mean spherical approximation ‎No edit summary
13:1013:10, 28 February 2007 diff hist +212‎ Mean spherical approximation ‎ →‎References
13:0513:05, 28 February 2007 diff hist +129‎ Percus Yevick ‎ →‎References
13:0313:03, 28 February 2007 diff hist +197‎ Percus Yevick ‎ →‎References
13:0113:01, 28 February 2007 diff hist +110‎ Percus Yevick ‎ →‎References
12:5712:57, 28 February 2007 diff hist +222‎ Percus Yevick ‎ →‎References
12:5412:54, 28 February 2007 diff hist +460‎ Percus Yevick ‎ →‎References
12:3712:37, 28 February 2007 diff hist −238‎ Ornstein-Zernike relation ‎No edit summary
12:3612:36, 28 February 2007 diff hist +155‎ Ornstein-Zernike relation ‎No edit summary
12:3512:35, 28 February 2007 diff hist +312‎ N Thermal potential ‎ New page: <math>\omega(r)</math> is the thermal potential, given by : <math>\omega(r) \equiv \gamma(r) + B(r)</math> where <math>\gamma(r)</math> is the [[Indirect correlation function | indirect c...
12:3212:32, 28 February 2007 diff hist +404‎ N Cavity correlation function ‎ New page: <math>y(r_{12})</math> is the cavity correlation function, given by :<math>y(r) \equiv g(r) /e^{-\beta \Phi(r)}</math> where <math>g(r)</math> is the [[Pair distribution function | pair...
12:2812:28, 28 February 2007 diff hist +53‎ N Direct correlation function ‎ New page: <math>c(1,2)</math> Category: Integral equations
12:2512:25, 28 February 2007 diff hist +233‎ N Total correlation function ‎ New page: <math>h(1,2)</math> is the ''total'' correlation function, given by : <math>h(1,2) \equiv g(r) -1</math>, where <math>g(r)</math> is the [[Pair distribution function | pair distribution f...
12:2212:22, 28 February 2007 diff hist +400‎ N Indirect correlation function ‎ New page: <math>\gamma (r)</math> is the indirect (or ''series'' or ''chain'') correlation function, given by :<math>\gamma (r) \equiv h(r) - c(r)</math>. where... current
12:0012:00, 28 February 2007 diff hist +118‎ SklogWiki:Site support ‎No edit summary

15:5815:58, 27 February 2007 diff hist +22‎ N Category:Physical constants ‎ New page: Physical constants
15:5715:57, 27 February 2007 diff hist +33‎ Avogadro constant ‎No edit summary
15:5515:55, 27 February 2007 diff hist +1‎ Integral equations ‎No edit summary
15:5515:55, 27 February 2007 diff hist +155‎ Integral equations ‎No edit summary
15:5115:51, 27 February 2007 diff hist −13‎ Ornstein-Zernike relation ‎No edit summary
15:5015:50, 27 February 2007 diff hist +298‎ N Mayer f-function ‎ New page: Definition: <math>f_{ij}=f(r_{ij})= \exp\left(-\frac{u(r)}{k_BT}\right) -1 </math> where * <math>k_B</math> is the Boltzmann constant * <math>T</math> is the temperature * <math>u(r...
15:3615:36, 27 February 2007 diff hist −2‎ Yukawa closure ‎No edit summary
15:3415:34, 27 February 2007 diff hist −3‎ Kirkwood superposition approximation ‎No edit summary
15:3215:32, 27 February 2007 diff hist +19‎ N John G. Kirkwood ‎ New page: Category:Person
15:3215:32, 27 February 2007 diff hist +2‎ Biographies ‎No edit summary
15:3115:31, 27 February 2007 diff hist +1‎ Kirkwood superposition approximation ‎No edit summary
15:3115:31, 27 February 2007 diff hist +292‎ Kirkwood superposition approximation ‎ →‎References
15:2915:29, 27 February 2007 diff hist +639‎ Kirkwood superposition approximation ‎No edit summary
15:1815:18, 27 February 2007 diff hist +20‎ Biographies ‎No edit summary
15:0615:06, 27 February 2007 diff hist −4‎ Ornstein-Zernike relation ‎ →‎References
15:0215:02, 27 February 2007 diff hist −8‎ Ornstein-Zernike relation from the grand canonical distribution function ‎No edit summary
15:0015:00, 27 February 2007 diff hist +15‎ Ornstein-Zernike relation from the grand canonical distribution function ‎No edit summary
14:5914:59, 27 February 2007 diff hist −48‎ Ornstein-Zernike relation from the grand canonical distribution function ‎No edit summary
14:5814:58, 27 February 2007 diff hist −100‎ Ornstein-Zernike relation from the grand canonical distribution function ‎No edit summary
14:5614:56, 27 February 2007 diff hist −23‎ Ornstein-Zernike relation from the grand canonical distribution function ‎No edit summary
14:5414:54, 27 February 2007 diff hist −53‎ Ornstein-Zernike relation from the grand canonical distribution function ‎No edit summary
14:5114:51, 27 February 2007 diff hist −25‎ Ornstein-Zernike relation from the grand canonical distribution function ‎No edit summary
14:4714:47, 27 February 2007 diff hist +1,917‎ N Ornstein-Zernike relation from the grand canonical distribution function ‎ New page: Defining the local activity by $z({\bf r})=z\exp[-\beta\psi({\bf r})]$ where $\beta=1/k_BT$, and $k_B$ is the Boltzmann constant. Using those definitions the grand canonical partition func...
14:4714:47, 27 February 2007 diff hist 0‎ Integral equations ‎No edit summary
14:4614:46, 27 February 2007 diff hist +78‎ Integral equations ‎No edit summary
12:3812:38, 27 February 2007 diff hist +182‎ N Jarzynski equality ‎ New page: ==References== #[http://dx.doi.org/10.1103/PhysRevLett.78.2690 C. Jarzynski "Nonequilibrium Equality for Free Energy Differences", Physical Review Letters '''78''' 2690-2693 (1997)]
12:3412:34, 27 February 2007 diff hist +24‎ Non-equilibrium thermodynamics ‎No edit summary
12:3412:34, 27 February 2007 diff hist −58‎ Evans-Searles transient fluctuation theorem ‎No edit summary
12:3312:33, 27 February 2007 diff hist +441‎ N Evans-Searles transient fluctuation theorem ‎ New page: ==References== #[http://dx.doi.org/10.1103/PhysRevE.50.1645 Denis J. Evans and Debra J. Searles "Equilibrium microstates which generate second law violating steady states", Physical Review...
12:2412:24, 27 February 2007 diff hist +24‎ N Non-equilibrium thermodynamics ‎ New page: *Fluctuation theorem
12:2312:23, 27 February 2007 diff hist +35‎ Statistical mechanics ‎No edit summary
12:2212:22, 27 February 2007 diff hist +18‎ Classical thermodynamics ‎No edit summary

20:1520:15, 26 February 2007 diff hist +262‎ N Planck constant ‎ New page: The '''Planck constant''' (<math>h</math>),is named after the German physicist Max Karl Ernst Ludwig Planck. Its value (in SI units, 2002 [http://www.codata.org/ CODATA]) is: :<math>...
20:0820:08, 26 February 2007 diff hist +421‎ N De Broglie thermal wavelength ‎ New page: The '''de Broglie thermal wavelength''' is defined as :<math>\Lambda= \sqrt{\frac{h^2}{2\pi mk_BT}}</math> where * ''h'' is the Planck constant * ''m'' is the mass * <math>k_B</ma...
19:5019:50, 26 February 2007 diff hist +35‎ Statistical mechanics ‎No edit summary
19:0019:00, 26 February 2007 diff hist +128‎ m User:Carl McBride ‎No edit summary
18:4018:40, 26 February 2007 diff hist +187‎ Nm SklogWiki:Bots ‎ New page: A registered bot account. Edits by an account with this set will not appear by default in Recent changes; this is intended for mass imports of data without flooding human edits from view. current
18:1418:14, 26 February 2007 diff hist +141‎ m Conferences ‎No edit summary
18:0718:07, 26 February 2007 diff hist 0‎ m AMBER -- Assisted Model Building with Energy Refinement ‎ Assisted Model Building with Energy Refinement (AMBER) moved to AMBER -- Assisted Model Building with Energy Refinement
18:0618:06, 26 February 2007 diff hist +63‎ m Materials Studio ‎No edit summary
18:0618:06, 26 February 2007 diff hist +288‎ Nm Materials Studio ‎ New page: [http://www.accelrys.com/products/mstudio/ Materials Studio] is a comprehensive suite of modeling and simulation solutions for studying chemicals and materials, including crystal structure...
18:0418:04, 26 February 2007 diff hist +103‎ m Materials modelling and computer simulation codes ‎No edit summary
17:5917:59, 26 February 2007 diff hist +63‎ m XCrysDen ‎No edit summary
17:5917:59, 26 February 2007 diff hist +63‎ m VMD ‎No edit summary
17:5917:59, 26 February 2007 diff hist +63‎ m Molecular Workbench ‎No edit summary
17:5917:59, 26 February 2007 diff hist +63‎ m DiMol2D ‎No edit summary
17:5817:58, 26 February 2007 diff hist +63‎ m NWChem ‎No edit summary
17:5817:58, 26 February 2007 diff hist +63‎ m Gaussian (computer program) ‎No edit summary
17:5817:58, 26 February 2007 diff hist +63‎ m Dalton ‎No edit summary
17:5817:58, 26 February 2007 diff hist +63‎ m WIEN2K ‎No edit summary
17:5817:58, 26 February 2007 diff hist +63‎ m CPMD ‎No edit summary
17:5717:57, 26 February 2007 diff hist +63‎ m VASP ‎No edit summary
17:5717:57, 26 February 2007 diff hist +63‎ m X-PLOR ‎No edit summary
17:5717:57, 26 February 2007 diff hist +63‎ m GROMACS ‎No edit summary
17:5717:57, 26 February 2007 diff hist +63‎ m CHARMM ‎No edit summary
17:5617:56, 26 February 2007 diff hist +63‎ m NAMD ‎No edit summary
17:5617:56, 26 February 2007 diff hist +63‎ m AMBER -- Assisted Model Building with Energy Refinement ‎No edit summary
17:5617:56, 26 February 2007 diff hist +63‎ m LAMMPS ‎No edit summary
17:5617:56, 26 February 2007 diff hist +48‎ Nm Category:Materials modeling and Computer simulation codes ‎ New page: Materials modeling and Computer simulation codes
17:5517:55, 26 February 2007 diff hist +63‎ m DL POLY ‎No edit summary
17:4817:48, 26 February 2007 diff hist +230‎ m Mathematics ‎No edit summary
17:3717:37, 26 February 2007 diff hist +404‎ m 1-dimensional hard rods ‎ →‎References
17:2617:26, 26 February 2007 diff hist +457‎ m Martynov Sarkisov ‎ →‎References
17:2017:20, 26 February 2007 diff hist +414‎ m Martynov Sarkisov ‎ →‎References
17:0217:02, 26 February 2007 diff hist +20‎ m Verlet modified ‎No edit summary
16:5616:56, 26 February 2007 diff hist −2‎ m Flexible molecules ‎ →‎Bond distances
16:5116:51, 26 February 2007 diff hist +97‎ m Fast Fourier transform ‎ →‎References
16:4716:47, 26 February 2007 diff hist +236‎ m Duh Henderson ‎ →‎References
16:4316:43, 26 February 2007 diff hist −101‎ m Duh Haymet ‎No edit summary
16:4216:42, 26 February 2007 diff hist +211‎ m Duh Haymet ‎ →‎References
16:3216:32, 26 February 2007 diff hist +14‎ m Lattice gas ‎No edit summary
16:3116:31, 26 February 2007 diff hist +24‎ m Reference hyper-netted chain ‎No edit summary
16:3016:30, 26 February 2007 diff hist +32‎ m Hyper-netted chain ‎No edit summary
16:2816:28, 26 February 2007 diff hist +307‎ m Verlet modified ‎ →‎References
16:2116:21, 26 February 2007 diff hist −3‎ m Hyper-netted chain ‎ →‎References
15:4915:49, 26 February 2007 diff hist +82‎ m RSOZ ‎No edit summary
15:4415:44, 26 February 2007 diff hist +566‎ m RSOZ ‎No edit summary
15:3815:38, 26 February 2007 diff hist +54‎ Nm SklogWiki:Community Portal ‎ New page: SklogWiki does not have a 'Community Portal' as yet...
15:2215:22, 26 February 2007 diff hist +100‎ m Metropolis Monte Carlo ‎No edit summary
15:1815:18, 26 February 2007 diff hist +2‎ m Models ‎No edit summary
15:1715:17, 26 February 2007 diff hist 0‎ m Hard dumbbell model ‎ Three-dimensional hard dumbells moved to Three-dimensional hard dumbbells
15:1715:17, 26 February 2007 diff hist +46‎ m Hard dumbbell model ‎No edit summary
14:3114:31, 26 February 2007 diff hist +5‎ m Hard spherocylinders ‎No edit summary
14:3114:31, 26 February 2007 diff hist +7‎ m Hard spherocylinders ‎No edit summary
14:2814:28, 26 February 2007 diff hist +675‎ m Hard spherocylinders ‎No edit summary
14:1114:11, 26 February 2007 diff hist 0‎ N File:Spherocylinder purple.png ‎No edit summary
14:1114:11, 26 February 2007 diff hist +47‎ Nm Hard spherocylinders ‎ New page: thumb|right
14:0414:04, 26 February 2007 diff hist 0‎ N File:Dumbell peagreen.png ‎No edit summary
14:0414:04, 26 February 2007 diff hist +42‎ Nm Hard dumbbell model ‎ New page: thumb|right
14:0014:00, 26 February 2007 diff hist 0‎ N File:Sphere green.png ‎No edit summary
14:0014:00, 26 February 2007 diff hist +39‎ m Hard sphere model ‎No edit summary
13:5613:56, 26 February 2007 diff hist +39‎ Nm Hard ellipsoid model ‎ New page: thumb|right
13:5413:54, 26 February 2007 diff hist 0‎ N File:Ellipsoid red.png ‎No edit summary
13:3013:30, 26 February 2007 diff hist +270‎ m Talk:Main Page ‎ Wikipedia: more details:
13:2413:24, 26 February 2007 diff hist +905‎ m SklogWiki style guide ‎No edit summary
13:0213:02, 26 February 2007 diff hist +499‎ m SklogWiki style guide ‎No edit summary
12:4912:49, 26 February 2007 diff hist −16‎ m Help:Contents ‎No edit summary
12:4812:48, 26 February 2007 diff hist +1,119‎ N SklogWiki style guide ‎ New page: ==Acronyms== Try to '''avoid the use of acronyms'''. You yourself may be over-familiar with a particular set of acronyms. However, SklogWiki is open to all, and acronyms can be confusing ...
12:1812:18, 26 February 2007 diff hist +27‎ m Help:Contents ‎No edit summary
12:1612:16, 26 February 2007 diff hist +3‎ m Isothermal-isobaric ensemble ‎No edit summary
12:1012:10, 26 February 2007 diff hist +94‎ m Researchers and research groups ‎ →‎Netherlands
12:0812:08, 26 February 2007 diff hist +193‎ m Researchers and research groups ‎ →‎United Kingdom
12:0312:03, 26 February 2007 diff hist +17‎ m Statistical mechanics ‎No edit summary
12:0012:00, 26 February 2007 diff hist +63‎ m Main Page ‎No edit summary

20:0420:04, 23 February 2007 diff hist +2‎ m Metropolis Monte Carlo ‎ →‎Main features
20:0420:04, 23 February 2007 diff hist −1‎ m Metropolis Monte Carlo ‎ →‎Temperature
19:3619:36, 23 February 2007 diff hist +101‎ Nm AMBER forcefield ‎ New page: *[http://amber.scripps.edu/#ff The force field] *[http://amber.scripps.edu/dbase.html The parameters]
19:2419:24, 23 February 2007 diff hist +19‎ m Liquid crystals ‎No edit summary
19:2419:24, 23 February 2007 diff hist +13‎ m Liquid crystals ‎No edit summary
19:1119:11, 23 February 2007 diff hist +21‎ m Integral equations ‎No edit summary
19:1119:11, 23 February 2007 diff hist +4‎ m Martynov Sarkisov ‎No edit summary
19:0919:09, 23 February 2007 diff hist −3‎ m Hard sphere model ‎No edit summary
19:0819:08, 23 February 2007 diff hist +2‎ m Widom-Rowlinson model ‎No edit summary
19:0619:06, 23 February 2007 diff hist −4‎ m Reverse Monte Carlo ‎No edit summary
19:0519:05, 23 February 2007 diff hist +18‎ m Monte Carlo methods ‎No edit summary
19:0419:04, 23 February 2007 diff hist +8‎ m Metropolis Monte Carlo ‎ →‎Advanced techniques
19:0219:02, 23 February 2007 diff hist +264‎ m Metropolis Monte Carlo ‎ →‎References
18:5918:59, 23 February 2007 diff hist +25‎ m Metropolis Monte Carlo ‎ →‎Temperature
18:5818:58, 23 February 2007 diff hist 0‎ m Statistical mechanics ‎No edit summary
18:5818:58, 23 February 2007 diff hist +29‎ m Statistical mechanics ‎No edit summary
18:5818:58, 23 February 2007 diff hist +2‎ m Metropolis Monte Carlo ‎ →‎Temperature
18:5718:57, 23 February 2007 diff hist +4‎ m Metropolis Monte Carlo ‎ →‎Temperature
18:5618:56, 23 February 2007 diff hist +4‎ m Metropolis Monte Carlo ‎ →‎Advanced techniques
18:5618:56, 23 February 2007 diff hist +1‎ m Monte Carlo methods ‎No edit summary
18:5618:56, 23 February 2007 diff hist +37‎ m Monte Carlo methods ‎No edit summary
18:4918:49, 23 February 2007 diff hist +39‎ m Gibbs-Duhem relation ‎No edit summary
18:3218:32, 23 February 2007 diff hist +24‎ Nm Category:Classical thermodynamics ‎ New page: Classical thermodynamics current
18:3118:31, 23 February 2007 diff hist +39‎ m Compressibility factor ‎No edit summary
18:3118:31, 23 February 2007 diff hist +39‎ m Thermodynamic relations ‎No edit summary
18:3018:30, 23 February 2007 diff hist +39‎ m Gibbs energy function ‎No edit summary
18:3018:30, 23 February 2007 diff hist +39‎ m Helmholtz energy function ‎No edit summary
18:2918:29, 23 February 2007 diff hist +13‎ m Boltzmann constant ‎No edit summary
18:2818:28, 23 February 2007 diff hist +1‎ m Boltzmann constant ‎No edit summary
18:2818:28, 23 February 2007 diff hist +58‎ m Boltzmann constant ‎No edit summary
18:2718:27, 23 February 2007 diff hist +39‎ m Enthalpy ‎No edit summary
18:2718:27, 23 February 2007 diff hist +40‎ m Second law of thermodynamics ‎No edit summary
18:2418:24, 23 February 2007 diff hist +39‎ m First law of thermodynamics ‎No edit summary
17:4717:47, 23 February 2007 diff hist +10‎ m List of closures for integral equations ‎No edit summary
17:4517:45, 23 February 2007 diff hist +866‎ Nm Verlet modified ‎ New page: The '''Verlet modified''' (1980) (Ref. 1) closure for hard sphere fluids, in terms of the cavity correlation function, is (Eq. 3) :<math>y(r) = \gamma (r) - A \frac{...
16:5816:58, 23 February 2007 diff hist 0‎ m XCrysDen ‎No edit summary
16:5616:56, 23 February 2007 diff hist +1‎ m Square well model ‎No edit summary
16:5516:55, 23 February 2007 diff hist 0‎ m Monte Carlo ‎No edit summary
16:5516:55, 23 February 2007 diff hist +1‎ m Lennard-Jones model ‎No edit summary
16:5516:55, 23 February 2007 diff hist +14‎ m Lennard-Jones model ‎No edit summary
16:5216:52, 23 February 2007 diff hist +344‎ Nm Fast Fourier transform ‎ New page: Invented by James W. Cooley and John W. Tukey in 1965 (Ref 1). The fast Fourier transform reduces the number of operations from <math>N^2</math> to <math>N \ln N</math>. ==References== #J...
16:4916:49, 23 February 2007 diff hist +1‎ m Boltzmann constant ‎No edit summary
16:4516:45, 23 February 2007 diff hist −8‎ m Boltzmann constant ‎No edit summary
16:4316:43, 23 February 2007 diff hist +4‎ m CPMD ‎No edit summary
16:4316:43, 23 February 2007 diff hist +3‎ m Kirkwood superposition approximation ‎No edit summary
16:4116:41, 23 February 2007 diff hist +1‎ m Hard core Yukawa potential ‎No edit summary
16:3916:39, 23 February 2007 diff hist −5‎ m Van der Waals equation of state ‎No edit summary
16:3816:38, 23 February 2007 diff hist +75‎ m Van der Waals equation of state ‎No edit summary
16:3516:35, 23 February 2007 diff hist +13‎ m DiMol2D ‎No edit summary
16:3416:34, 23 February 2007 diff hist 0‎ m 1-dimensional Ising model ‎ 1dimensional Ising model moved to 1-dimensional Ising model
16:3416:34, 23 February 2007 diff hist 0‎ m 1-dimensional Ising model ‎ Ising Model 1dimensional moved to 1dimensional Ising model
16:3216:32, 23 February 2007 diff hist +5‎ m Ising model ‎ →‎Ising Model (1 dimensional)
16:3116:31, 23 February 2007 diff hist 0‎ m 1-dimensional Ising model ‎ Ising Model 1d moved to Ising Model 1dimensional
16:3116:31, 23 February 2007 diff hist −15‎ m Ising model ‎ →‎Ising Model (1 dimensional)
15:4215:42, 23 February 2007 diff hist +80‎ m Variables ‎No edit summary
15:3815:38, 23 February 2007 diff hist −12‎ m Variables ‎No edit summary
15:3815:38, 23 February 2007 diff hist −167‎ m Template:Variables ‎No edit summary current
15:3315:33, 23 February 2007 diff hist +409‎ m Template:Variables ‎No edit summary
15:3215:32, 23 February 2007 diff hist +1‎ m Template:Variables ‎No edit summary
15:2415:24, 23 February 2007 diff hist +466‎ Nm Template:Infobox ‎ New page: {| class="infobox bordered" style="width: 25em; text-align: left; font-size: 95%;" |+ style="font-size: larger;" | '''{{{name}}}''' |- | colspan="2" style="text-align:center;" | [[Image:{{...
15:2415:24, 23 February 2007 diff hist +12‎ m Variables ‎No edit summary
15:2015:20, 23 February 2007 diff hist +26‎ Nm Template:Variables ‎ New page: {{Variables| p=pressure }}
15:1915:19, 23 February 2007 diff hist +13‎ Nm Variables ‎ New page: {{Variables}}
15:0715:07, 23 February 2007 diff hist +15‎ m Help:Contents ‎No edit summary
14:2114:21, 23 February 2007 diff hist +21‎ m List of closures for integral equations ‎No edit summary
14:2014:20, 23 February 2007 diff hist +1‎ m Duh Haymet ‎No edit summary
14:2014:20, 23 February 2007 diff hist +606‎ Nm Duh Haymet ‎ New page: The '''Duh-Haymet''' (Ref. 1) (1995) Padé (3/2) approximation for the Bridge function for the Lennard Jones system is (Eq. 13) <math>B(\gamma^{*})= - \frac{1}{2} \gamma^{*2} \left...
14:1714:17, 23 February 2007 diff hist +279‎ Nm Duh Henderson ‎ New page: The '''Duh-Henderson''' (Ref. 1) (1996) Bridge function retains the Duh Haymet Bridge function for <math>\gamma^{*} \geq 0</math>, and for <math>\gamma^{*} \leq 0</math> (Eq. 17) :...
14:1514:15, 23 February 2007 diff hist +35‎ m List of closures for integral equations ‎No edit summary
14:1314:13, 23 February 2007 diff hist +4‎ m Mean spherical approximation ‎No edit summary
14:1214:12, 23 February 2007 diff hist +41‎ m Mean spherical approximation ‎No edit summary
14:1014:10, 23 February 2007 diff hist +50‎ m Mean spherical approximation ‎No edit summary
14:0814:08, 23 February 2007 diff hist +11‎ m Mean spherical approximation ‎No edit summary
14:0214:02, 23 February 2007 diff hist +1,327‎ Nm Mean spherical approximation ‎ New page: The '''Lebowitz and Percus''' mean spherical approximation (MSA) (1966) \cite{PR_1966_144_000251} closure is given by <math>c(r) = -\beta \omega(r), ~~~~ r>\sigma.</math> The {\bf Blum a...
13:5913:59, 23 February 2007 diff hist +409‎ Nm Soft-core mean spherical approximation ‎ New page: Chihara (along with Madden and Rice) extended the Percus Yevick equation for Lennard-Jones systems to provide a soft-core [[Mean spherical approximation | mean spherical approximat...
13:5613:56, 23 February 2007 diff hist +44‎ m List of closures for integral equations ‎No edit summary
13:5613:56, 23 February 2007 diff hist +25‎ m List of closures for integral equations ‎No edit summary
13:5513:55, 23 February 2007 diff hist +15‎ m Martynov Sarkisov ‎No edit summary
13:5413:54, 23 February 2007 diff hist +65‎ m Martynov Sarkisov ‎No edit summary
13:5313:53, 23 February 2007 diff hist +2‎ m Martynov Sarkisov ‎No edit summary
13:5313:53, 23 February 2007 diff hist +1,115‎ Nm Martynov Sarkisov ‎ New page: '''Martynov''' and '''Sarkisov''' proposed an expansion of the Bridge function in terms of basis functions: <math>B(\rho, T, r)= - \sum_{i=1}^\infty A_i (\rho,T) \phi^i (\rho, T, r)</math...
13:4813:48, 23 February 2007 diff hist +54‎ m Martynov Sarkisov Vompe ‎No edit summary
13:4513:45, 23 February 2007 diff hist +1‎ m Ornstein-Zernike relation ‎No edit summary
13:4513:45, 23 February 2007 diff hist +2‎ m Ornstein-Zernike relation ‎No edit summary
13:4413:44, 23 February 2007 diff hist +22‎ m Yukawa closure ‎No edit summary
13:4313:43, 23 February 2007 diff hist +598‎ Nm Martynov Vompe ‎ New page: The '''Martynov-Vompe''' (Refs. 1 and 2) closure :<math>\left.B\right.=-a(\ln y^*) - b(\ln y^*)^2</math> where :<math>\left.y^*(r)\right. = \ln y(r) - \beta \Phi_p</math> where <math>...
13:3813:38, 23 February 2007 diff hist +20‎ m List of closures for integral equations ‎No edit summary
13:3813:38, 23 February 2007 diff hist +440‎ Nm Martynov Sarkisov Vompe ‎ New page: The Martynov-Sarkisov-Vompe (MSV) (1999) (Eq. 33 Ref. 1) closure is given in terms of the bridge function :<math>B^{(2)}(r) = - \frac{1}{2} (\omega - \phi)^2</math> where :<math>\left....
13:3613:36, 23 February 2007 diff hist +43‎ m List of closures for integral equations ‎No edit summary
13:2813:28, 23 February 2007 diff hist −8‎ m Reference hyper-netted chain ‎No edit summary
13:2613:26, 23 February 2007 diff hist +6‎ m Exact solution of the Percus Yevick integral equation for hard spheres ‎No edit summary
13:2513:25, 23 February 2007 diff hist −7‎ m Exact solution of the Percus Yevick integral equation for hard spheres ‎No edit summary
13:2413:24, 23 February 2007 diff hist −6‎ m Exact solution of the Percus Yevick integral equation for hard spheres ‎No edit summary
13:2213:22, 23 February 2007 diff hist +22‎ m Exact solution of the Percus Yevick integral equation for hard spheres ‎No edit summary
13:2013:20, 23 February 2007 diff hist −138‎ m Exact solution of the Percus Yevick integral equation for hard spheres ‎No edit summary
13:1913:19, 23 February 2007 diff hist +1,328‎ Nm Exact solution of the Percus Yevick integral equation for hard spheres ‎ New page: The exact solution for the Percus-Yevick integral equation for hard spheres was derived by M. S. Wertheim in 1963 \cite{PRL_1963_10_000321} (See also \cite{JMP_1964_05_00643}) (and for mix...
13:1813:18, 23 February 2007 diff hist +76‎ m List of closures for integral equations ‎No edit summary
13:1513:15, 23 February 2007 diff hist −95‎ m Percus Yevick ‎No edit summary
13:1313:13, 23 February 2007 diff hist −32‎ m Percus Yevick ‎No edit summary
13:1213:12, 23 February 2007 diff hist +70‎ m Percus Yevick ‎No edit summary
13:0913:09, 23 February 2007 diff hist −78‎ m Percus Yevick ‎No edit summary
13:0413:04, 23 February 2007 diff hist +1,460‎ Nm Percus Yevick ‎ New page: If one defines a class of diagrams by the linear combination (Eq. 5.18 \cite{RPP_1965_28_0169}) (See G. Stell \cite{P_1963_29_0517_nolotengoElsevier}) \begin{equation} D(r) = y(r) + c(r) -...
13:0213:02, 23 February 2007 diff hist +118‎ m Cluster diagrams ‎No edit summary
13:0113:01, 23 February 2007 diff hist +1,055‎ Nm Cluster diagrams ‎ New page: ==Chain clusters== A ''chain'' is a cluster with at least one node. All routes from one base point to the other pass through at least one nodal field point. Cutting at this point separates...
12:4712:47, 23 February 2007 diff hist +76‎ Nm Gibbs-Duhem relation ‎ New page: :<math> \left.\frac{\partial P}{\partial \mu}\right\vert_{T} = \rho</math>
12:4712:47, 23 February 2007 diff hist +26‎ m Classical thermodynamics ‎No edit summary
12:4512:45, 23 February 2007 diff hist +337‎ Nm Boltzmann distribution ‎ New page: The Maxwell-Boltzmann distribution function is a function ''f(E)'' which gives the probability that a given particle has the energy ''E''. This distribution is ''classical'' and is used to...
12:4412:44, 23 February 2007 diff hist +28‎ m Statistical mechanics ‎No edit summary
12:4012:40, 23 February 2007 diff hist +249‎ m Linear congruential generator ‎No edit summary
12:3512:35, 23 February 2007 diff hist +26‎ m Thermodynamic integration ‎No edit summary
12:2912:29, 23 February 2007 diff hist +45‎ m First law of thermodynamics ‎No edit summary
12:2712:27, 23 February 2007 diff hist +148‎ m Ergodic hypothesis ‎No edit summary
12:2512:25, 23 February 2007 diff hist +28‎ m Ising model ‎ →‎Ising Model
12:2112:21, 23 February 2007 diff hist +19‎ m Ising model ‎ →‎Ising Model (1d)
12:0712:07, 23 February 2007 diff hist +295‎ m Talk:Ideal gas partition function ‎No edit summary current

20:1020:10, 22 February 2007 diff hist +9‎ m Ideal gas partition function ‎No edit summary
20:0820:08, 22 February 2007 diff hist +22‎ m Enthalpy ‎No edit summary
20:0320:03, 22 February 2007 diff hist +129‎ m Talk:Ideal gas assumptions ‎No edit summary
20:0220:02, 22 February 2007 diff hist −189‎ m Ideal gas partition function ‎No edit summary
19:3719:37, 22 February 2007 diff hist +1‎ m Talk:Ideal gas assumptions ‎No edit summary
19:3619:36, 22 February 2007 diff hist +137‎ m Talk:Ideal gas assumptions ‎No edit summary
19:3519:35, 22 February 2007 diff hist −26‎ m Ideal gas partition function ‎No edit summary
19:3219:32, 22 February 2007 diff hist −129‎ m Ideal gas partition function ‎No edit summary
19:2319:23, 22 February 2007 diff hist +110‎ Nm Ideal gas assumptions ‎ New page: *All collisions are perfectly elastic *No interatomic attractive forces *Atoms have no extent (no finite size)
19:2219:22, 22 February 2007 diff hist +27‎ m Ideal gas ‎No edit summary
19:2119:21, 22 February 2007 diff hist +48‎ m Equation of State: Ideal Gas ‎No edit summary
19:2019:20, 22 February 2007 diff hist +2,732‎ Nm Ideal gas partition function ‎ New page: Canonical Ensemble Partition function, $Q$, for a system of $N$ identical particles each of mass $m$ \begin{equation} Q_{NVT}=\frac{1}{N!}\frac{1}{h^{3N}}\int\int d{\bf p}^N d{\bf r}^N \ex...
19:1919:19, 22 February 2007 diff hist +10‎ m Ideal gas ‎No edit summary
19:1319:13, 22 February 2007 diff hist +98‎ m Talk:Second law of thermodynamics ‎No edit summary current
19:1219:12, 22 February 2007 diff hist −2‎ m Gibbs energy function ‎No edit summary
19:1219:12, 22 February 2007 diff hist −39‎ m Gibbs energy function ‎No edit summary
19:1119:11, 22 February 2007 diff hist +23‎ m Gibbs energy function ‎No edit summary
19:1019:10, 22 February 2007 diff hist +11‎ m Gibbs energy function ‎No edit summary
19:0919:09, 22 February 2007 diff hist +520‎ Nm Gibbs energy function ‎ New page: Definition: :<math>\left.G\right.=A+pV</math> :<math>\left.G\right.=U-TS+pV</math> Taking the total derivative :<math>\left.dG\right.=dU-TdS-SdT+pdV+Vdp</math> but from equation \ref...
19:0519:05, 22 February 2007 diff hist +39‎ m Second law of thermodynamics ‎No edit summary
19:0419:04, 22 February 2007 diff hist +10‎ m Enthalpy ‎No edit summary
19:0319:03, 22 February 2007 diff hist +491‎ Nm Enthalpy ‎ New page: Definition: :<math>\left.H\right.=U+pV</math> ''(-pV)'' is a ''conjugate pair''. The differential of this function is :<math>\left.dH\right.=dU+pdV+Vdp</math> but from equation \ref{se...
18:5918:59, 22 February 2007 diff hist −21‎ m Canonical ensemble ‎No edit summary
18:5818:58, 22 February 2007 diff hist 0‎ m Canonical ensemble ‎No edit summary
18:5718:57, 22 February 2007 diff hist +25‎ m Helmholtz energy function ‎No edit summary
18:5518:55, 22 February 2007 diff hist +10‎ m Helmholtz energy function ‎No edit summary
18:5418:54, 22 February 2007 diff hist +628‎ Nm Helmholtz energy function ‎ New page: Hermann Ludwig Ferdinand von Helmholtz Definition: :<math>\left.A\right.=U-TS</math> ''(TS)'' is a ''conjugate pair''. The differential of this function is :<math>\left.dA\right.=d...
18:2418:24, 22 February 2007 diff hist +19‎ m Ising model ‎No edit summary
18:2418:24, 22 February 2007 diff hist +12‎ Nm Ising model ‎ New page: *History
18:2018:20, 22 February 2007 diff hist +622‎ Nm Lattice gas ‎ New page: The so called `lattice gas' of Lee and Yang was an adaptation of the Ising model, where the spins up and down were replaced by occupied or un-occupied sites (See Ref.s 1 and 2). ==Ref...
18:1318:13, 22 February 2007 diff hist +273‎ m Models ‎No edit summary
18:0018:00, 22 February 2007 diff hist 0‎ m Hard sphere: virial coefficients ‎No edit summary
18:0018:00, 22 February 2007 diff hist +8‎ m Hard sphere: virial coefficients ‎No edit summary
17:5817:58, 22 February 2007 diff hist +98‎ m Hard hexagon lattice model ‎ →‎References
17:5517:55, 22 February 2007 diff hist +255‎ Nm Hard disk model ‎ New page: ==References== #[http://dx.doi.org/10.1063/1.1446842 Carl McBride and Carlos Vega "Fluid solid equilibrium for two dimensional tangent hard disk chains from Wertheim's perturbation th...
17:5317:53, 22 February 2007 diff hist +16‎ m Models ‎No edit summary
17:4717:47, 22 February 2007 diff hist +217‎ m Hard sphere: virial coefficients ‎ →‎References
17:4217:42, 22 February 2007 diff hist +64‎ m Hard sphere: virial coefficients ‎ →‎References
17:2517:25, 22 February 2007 diff hist +56‎ m Widom-Rowlinson model ‎ →‎References
16:2516:25, 22 February 2007 diff hist +135‎ m Researchers and research groups ‎No edit summary
16:2116:21, 22 February 2007 diff hist +123‎ m Researchers and research groups ‎No edit summary
16:2016:20, 22 February 2007 diff hist +81‎ m Researchers and research groups ‎ →‎United States of America
16:1416:14, 22 February 2007 diff hist +234‎ m Researchers and research groups ‎ →‎United States of America
15:3715:37, 22 February 2007 diff hist +276‎ m SklogWiki:About ‎No edit summary
15:3515:35, 22 February 2007 diff hist 0‎ N File:Qft.gif ‎No edit summary current
15:3015:30, 22 February 2007 diff hist +9‎ N File:Logocsict rgb72 070x109.png ‎ CSIC logo current
14:5014:50, 22 February 2007 diff hist +2‎ m Researchers and research groups ‎ →‎Mexico
14:4914:49, 22 February 2007 diff hist 0‎ m Researchers and research groups ‎ →‎Spain
14:4814:48, 22 February 2007 diff hist +6‎ m Researchers and research groups ‎ →‎United States of America
14:4114:41, 22 February 2007 diff hist +122‎ m Researchers and research groups ‎ →‎Mexico
14:2314:23, 22 February 2007 diff hist +1‎ m Researchers and research groups ‎ →‎Czech Republic
14:2214:22, 22 February 2007 diff hist +107‎ m Researchers and research groups ‎ →‎Mexico
14:1814:18, 22 February 2007 diff hist +96‎ m Researchers and research groups ‎ →‎Mexico
14:1414:14, 22 February 2007 diff hist +102‎ m Researchers and research groups ‎ →‎Mexico
14:0714:07, 22 February 2007 diff hist +79‎ m Researchers and research groups ‎ →‎United States of America
14:0214:02, 22 February 2007 diff hist +60‎ m Statistical mechanics ‎No edit summary
12:5712:57, 22 February 2007 diff hist +96‎ m Researchers and research groups ‎ →‎Australia
12:5512:55, 22 February 2007 diff hist +81‎ m Researchers and research groups ‎ →‎United States of America
12:5312:53, 22 February 2007 diff hist +101‎ m Researchers and research groups ‎ →‎Australia
12:5012:50, 22 February 2007 diff hist +100‎ m Researchers and research groups ‎No edit summary
12:4112:41, 22 February 2007 diff hist +136‎ m Researchers and research groups ‎No edit summary
12:3512:35, 22 February 2007 diff hist +110‎ m Researchers and research groups ‎ →‎United States of America

21:2021:20, 21 February 2007 diff hist 0‎ m 1-dimensional hard rods ‎No edit summary
21:1721:17, 21 February 2007 diff hist +15‎ m Models ‎No edit summary
21:1721:17, 21 February 2007 diff hist 0‎ m 1-dimensional hard rods ‎ Hard Rods moved to Hard rods
21:1621:16, 21 February 2007 diff hist 0‎ m Hard sphere model ‎No edit summary
21:1621:16, 21 February 2007 diff hist −1‎ m 1-dimensional hard rods ‎No edit summary
21:1521:15, 21 February 2007 diff hist +41‎ m 1-dimensional hard rods ‎ →‎References
21:1321:13, 21 February 2007 diff hist +168‎ m 1-dimensional hard rods ‎No edit summary
20:1920:19, 21 February 2007 diff hist +111‎ m Researchers and research groups ‎ →‎Italy
20:1320:13, 21 February 2007 diff hist 0‎ m Metropolis Monte Carlo ‎ →‎Boundary Conditions
20:1120:11, 21 February 2007 diff hist +101‎ m Researchers and research groups ‎ →‎United States of America
20:0920:09, 21 February 2007 diff hist +102‎ m Researchers and research groups ‎ →‎Germany
20:0720:07, 21 February 2007 diff hist +143‎ m Researchers and research groups ‎ →‎Germany
19:5919:59, 21 February 2007 diff hist +182‎ m Researchers and research groups ‎ →‎United Kingdom
19:5219:52, 21 February 2007 diff hist +5‎ m Researchers and research groups ‎ →‎Spain
17:5217:52, 21 February 2007 diff hist +35‎ m Porous media ‎No edit summary
17:4317:43, 21 February 2007 diff hist +1,250‎ Nm RSOZ for polydisperse systems ‎ New page: For a polydisperse fluid, composed of <math>n_f</math> components, in a polydisperse matrix, composed of <math>n_m</math> components, written in matrix form in Fourier space (see Eq. 18 of...
17:3117:31, 21 February 2007 diff hist +90‎ m Porous media ‎No edit summary
17:2617:26, 21 February 2007 diff hist −26‎ m Lennard-Jones model ‎No edit summary
17:1917:19, 21 February 2007 diff hist +581‎ Nm Ergodic hypothesis ‎ New page: The Ergodic hypothesis (Ref 1 and 2) essentially states that an ensemble average (MC) of an observable, <math>< O >_\mu</math> is equivalent to the time average, <math>\overline{O}_T</mat...
17:0917:09, 21 February 2007 diff hist +70‎ m Mathematics ‎No edit summary
17:0817:08, 21 February 2007 diff hist +340‎ Nm Stirling's approximation ‎ New page: James Stirling (1692-1770, Scotland) :<math>\left.\ln N!\right. = \ln 1 + \ln 2 + \ln 3 + ... + \ln N</math> :<math> ~= \sum_{k=1}^N \ln k</math> :<math>~\approx \int_1^N \ln x dx</ma...
17:0517:05, 21 February 2007 diff hist +29‎ Nm Mathematics ‎ New page: *Stirling's approximation
17:0517:05, 21 February 2007 diff hist +17‎ m Main Page ‎No edit summary
16:5716:57, 21 February 2007 diff hist +11‎ m MOZ ‎No edit summary
16:5516:55, 21 February 2007 diff hist +1,035‎ Nm MOZ ‎ New page: The Ornstein-Zernike equations for mixtures of monomers with coincident oligomers (coincident dimers, trimers,...,''n''-mers). :<math>h_{an}(r) - c_{an}(r...
16:4816:48, 21 February 2007 diff hist +8‎ Nm Integral equations for mixtures ‎ New page: *MOZ
16:4516:45, 21 February 2007 diff hist −95‎ m RSOZ ‎No edit summary
16:3116:31, 21 February 2007 diff hist +3,669‎ Nm RSOZ ‎ New page: Given and Stell \cite{JCP_1992_97_04573,PA_1994_209_0495} provided {\bf exact} OZ equations for two-phase random media based on the original work of Madden and Glandt \cite{JSP_1988_51_053...
16:2916:29, 21 February 2007 diff hist +9‎ Nm Porous media ‎ New page: *RSOZ
16:2916:29, 21 February 2007 diff hist +18‎ m Integral equations ‎No edit summary
16:2716:27, 21 February 2007 diff hist +37‎ Nm Liquid crystals ‎ New page: *Nematic phase *Smectic phase
16:2416:24, 21 February 2007 diff hist +31‎ Nm Compressibility factor ‎ New page: <math>Z=\frac{pV}{Nk_BT}</math>
16:2316:23, 21 February 2007 diff hist +28‎ m Classical thermodynamics ‎No edit summary
16:2016:20, 21 February 2007 diff hist +13‎ m Ideal gas Helmholtz energy function ‎No edit summary
14:0414:04, 21 February 2007 diff hist +543‎ Nm Ideal gas Helmholtz energy function ‎ New page: From equations :<math>Q_{NVT}=\frac{1}{N!} \left( \frac{V}{\Lambda^{3}}\right)^N</math> and :<math>A=-k_B T \ln Q_{NVT}</math> one has :<math>A=-k_BT\left(\ln \frac{1}{N!} + N\ln\frac{V}...
13:5813:58, 21 February 2007 diff hist +41‎ m Ideal gas ‎No edit summary
13:5613:56, 21 February 2007 diff hist +465‎ Nm Thermodynamic integration ‎ New page: Used to calculate the free energy difference between two states. The path must be ''continuous'' and ''reversible''. One has a continuously variable energy function <math>U_\lambda</math>...
13:5013:50, 21 February 2007 diff hist +31‎ m Classical thermodynamics ‎No edit summary
13:4613:46, 21 February 2007 diff hist +23‎ m Reverse Monte Carlo ‎No edit summary
13:4513:45, 21 February 2007 diff hist +496‎ Nm Structure factor ‎ New page: <math>S(k)</math> for a monatomic system is defined by: <math>S(k) = 1 + \frac{4 \pi \rho}{k} \int_0^{\infty} ( g_2(r) -1 ) r \sin (kr) ~dr</math> where <math>k</math> is the scattering...
13:4013:40, 21 February 2007 diff hist +22‎ m Statistical mechanics ‎No edit summary
13:1313:13, 21 February 2007 diff hist +142‎ m Reverse Monte Carlo ‎ →‎References
12:4412:44, 21 February 2007 diff hist −25‎ m Isothermal-isobaric ensemble ‎No edit summary
12:4112:41, 21 February 2007 diff hist +315‎ m Researchers and research groups ‎ →‎United States of America
12:3512:35, 21 February 2007 diff hist −19‎ m Researchers and research groups ‎ →‎Spain
12:2812:28, 21 February 2007 diff hist +107‎ m Researchers and research groups ‎ →‎Italy
12:2512:25, 21 February 2007 diff hist +143‎ m Researchers and research groups ‎ →‎United States of America
12:1712:17, 21 February 2007 diff hist +45‎ m Main Page ‎No edit summary

19:3219:32, 20 February 2007 diff hist +50‎ m Prime modulus multiplicative linear congruential generator ‎No edit summary
19:3119:31, 20 February 2007 diff hist +872‎ Nm Prime modulus multiplicative linear congruential generator ‎ New page: The parameter <math>m</math> should be prime and as large as possible without causing a numerical overflow on the computer that it is running on. For example, for a 32-bit (31 bit + 1 sign...
19:2819:28, 20 February 2007 diff hist +139‎ m Linear congruential generator ‎No edit summary
19:2619:26, 20 February 2007 diff hist +263‎ Nm Linear congruential generator ‎ New page: The Lehmer algorithm can be written as <math>y_{n+1}\equiv ay_n + b~~~(\mod ~m),</math> where the user chooses <math>a</math>, <math>b</math>, <math>m</math>, and a seed value to initiat...
19:1419:14, 20 February 2007 diff hist +71‎ m Boltzmann constant ‎No edit summary
18:4418:44, 20 February 2007 diff hist +105‎ m Researchers and research groups ‎ →‎Spain
18:3118:31, 20 February 2007 diff hist −65‎ m Biographies ‎No edit summary
18:1818:18, 20 February 2007 diff hist +90‎ m Researchers and research groups ‎ →‎United States of America
18:1318:13, 20 February 2007 diff hist +204‎ m Researchers and research groups ‎No edit summary
18:0418:04, 20 February 2007 diff hist +164‎ m Researchers and research groups ‎ →‎United States of America
17:5717:57, 20 February 2007 diff hist +14‎ m Researchers and research groups ‎ →‎Spain
17:5617:56, 20 February 2007 diff hist +79‎ m Researchers and research groups ‎ →‎Spain
17:5317:53, 20 February 2007 diff hist +447‎ m Researchers and research groups ‎No edit summary
17:4117:41, 20 February 2007 diff hist +615‎ m Researchers and research groups ‎No edit summary
17:3017:30, 20 February 2007 diff hist +120‎ m Researchers and research groups ‎No edit summary
16:5916:59, 20 February 2007 diff hist +646‎ m Ornstein-Zernike relation ‎No edit summary
16:3916:39, 20 February 2007 diff hist 0‎ N File:Oz diag.png ‎No edit summary
16:3416:34, 20 February 2007 diff hist +575‎ m Ornstein-Zernike relation ‎No edit summary
16:2516:25, 20 February 2007 diff hist −100‎ m Ornstein-Zernike relation ‎No edit summary
16:2116:21, 20 February 2007 diff hist −278‎ m Ornstein-Zernike relation ‎No edit summary
16:1116:11, 20 February 2007 diff hist +115‎ m Ornstein-Zernike relation ‎No edit summary
16:0316:03, 20 February 2007 diff hist +53‎ m Ornstein-Zernike relation ‎No edit summary
15:5615:56, 20 February 2007 diff hist −144‎ m Ornstein-Zernike relation ‎No edit summary
15:5115:51, 20 February 2007 diff hist +3,752‎ Nm Ornstein-Zernike relation ‎ New page: Notation:\\ $g(r)$ is the {\bf pair distribution} function.\\ $\Phi(r)$ is the {\bf pair potential} acting between pairs.\\ $h(1,2)$ is the {\bf total} correlation function, $h(1,2) \equiv...
15:0015:00, 20 February 2007 diff hist +31‎ m Main Page ‎No edit summary
14:4314:43, 20 February 2007 diff hist +361‎ Nm Second law of thermodynamics ‎ New page: For a reversible change :<math>dQ=TdS</math> Thus for a closed system (<math>n</math> fixed): :<math>dU=TdS -PdV</math> For an open system: :<math>dU=TdS -PdV + \mu dN</math> For <ma...
14:4014:40, 20 February 2007 diff hist +878‎ Nm First law of thermodynamics ‎ New page: Conservation of energy. :<math>dU=dQ+dW</math> Where <math>U</math> is the internal energy of the system, i.e. ignoring the external energy of the system, for example motion of the cente...
14:3614:36, 20 February 2007 diff hist +543‎ Nm Thermodynamic relations ‎ New page: Also known as coefficient relations. <math>T=\left(\frac{\partial U}{\partial S}\right)_V </math> <math> P=-\left(\frac{\partial U}{\partial V}\right)_S </math> <math>T=\left(\frac{\pa...
14:1814:18, 20 February 2007 diff hist +441‎ Nm SklogWiki:General disclaimer ‎ New page: SklogWiki is an online open-content collaborative project, that is, a voluntary association of individuals and groups working to develop a common resource of human knowledge. The structure...
14:1614:16, 20 February 2007 diff hist +1,108‎ Nm SklogWiki:Privacy policy ‎ New page: ==Identification of an author== When you publish a page in the wiki, you may be logged in or not. If you are logged in, you will be identified by your user name. This may be your real na...
13:4713:47, 20 February 2007 diff hist −25‎ m Virial coefficients of model systems ‎No edit summary
12:0712:07, 20 February 2007 diff hist +71‎ m SklogWiki:About ‎No edit summary

21:0321:03, 19 February 2007 diff hist +232‎ Nm Yukawa closure ‎ New page: The '''Yukawa''' closure for hard spheres is <math>g_{ij}(r) \equiv h_{ij}(r) +1=0 ~~~~~~~~ r < \sigma_{ij} = (\sigma_i + \sigma_j)/2</math> and <math>c_{ij}(r)= \sum_{n=1} \frac{K_{ij}...
20:5720:57, 19 February 2007 diff hist −15‎ m Reference hyper-netted chain ‎No edit summary
20:4520:45, 19 February 2007 diff hist +3‎ m Canonical ensemble ‎No edit summary
20:4420:44, 19 February 2007 diff hist −116‎ m Reference hyper-netted chain ‎No edit summary
20:2920:29, 19 February 2007 diff hist +2,372‎ Nm Reference hyper-netted chain ‎ New page: (Note: the reference-HNC (RHNC) is somtimes referred to as the modified-HNC (MHNC) \cite{PRA_1979_20_001208}). Rosenfeld and Ashcroft (1979) \cite{PRA_1979_20_001208} proposed the `anzatz...
20:1320:13, 19 February 2007 diff hist +6‎ m Reverse Monte Carlo ‎No edit summary
20:1220:12, 19 February 2007 diff hist −1‎ m Reverse Monte Carlo ‎No edit summary
20:1220:12, 19 February 2007 diff hist +15‎ m Reverse Monte Carlo ‎No edit summary
19:5819:58, 19 February 2007 diff hist +56‎ m Metropolis Monte Carlo ‎No edit summary
19:5519:55, 19 February 2007 diff hist −11‎ m Reverse Monte Carlo ‎No edit summary
19:5219:52, 19 February 2007 diff hist +150‎ m Reverse Monte Carlo ‎ →‎References
19:4819:48, 19 February 2007 diff hist +8‎ m Metropolis Monte Carlo ‎No edit summary
19:4519:45, 19 February 2007 diff hist +16‎ m Metropolis Monte Carlo ‎No edit summary
19:4419:44, 19 February 2007 diff hist 0‎ m Random numbers ‎ Random Numbers moved to Random numbers
18:3718:37, 19 February 2007 diff hist −14‎ m SklogWiki:Bureaucrats ‎No edit summary current
18:3718:37, 19 February 2007 diff hist −41‎ m SklogWiki:Administrators ‎No edit summary current
18:3218:32, 19 February 2007 diff hist +134‎ Nm SklogWiki:Bureaucrats ‎ New page: === bureaucrat === This is a user that is allowed to turn other users into sysops via the aforementioned Special:Userrights page.
18:3118:31, 19 February 2007 diff hist +331‎ Nm SklogWiki:Administrators ‎ New page: === sysop === This is the most common privileged user. A user marked as 'sysop' can delete and undelete pages, protect and unprotect pages, block and unblock IPs, issue read-only SQL quer...
17:4217:42, 19 February 2007 diff hist +171‎ m Kirkwood superposition approximation ‎No edit summary
17:2417:24, 19 February 2007 diff hist +206‎ m Hyper-netted chain ‎ →‎References
17:0917:09, 19 February 2007 diff hist +8,938‎ Nm LaTeX math markup ‎ New page: == Subscripts, superscripts, integrals == {| border="2" cellpadding="4" cellspacing="0" style="margin: 1em 1em 1em 0; background: #f9f9f9; border: 1px #aaa solid; border-collapse: collaps...
17:0017:00, 19 February 2007 diff hist +38‎ Nm Help:Contents ‎ New page: *LaTeX math markup *References
16:5216:52, 19 February 2007 diff hist +1,859‎ m Hyper-netted chain ‎ →‎References
16:2516:25, 19 February 2007 diff hist +46‎ m Hyper-netted chain ‎No edit summary
15:3615:36, 19 February 2007 diff hist +40‎ m Researchers and research groups ‎ →‎Germany
15:3415:34, 19 February 2007 diff hist +730‎ m Researchers and research groups ‎No edit summary
14:5414:54, 19 February 2007 diff hist +96‎ m Researchers and research groups ‎No edit summary
14:5014:50, 19 February 2007 diff hist +51‎ m Equations of state ‎No edit summary
14:4014:40, 19 February 2007 diff hist +16‎ m Main Page ‎No edit summary
14:3914:39, 19 February 2007 diff hist 0‎ m Researchers and research groups ‎ Research groups moved to Researchers and research groups
12:4012:40, 19 February 2007 diff hist +18‎ m Force fields ‎No edit summary
12:3812:38, 19 February 2007 diff hist +10‎ Nm Force fields ‎ New page: *AMBER
12:3712:37, 19 February 2007 diff hist +44‎ Nm GROMACS ‎ New page: ==External links== [http://www.gromacs.org/]
12:3712:37, 19 February 2007 diff hist +43‎ Nm CHARMM ‎ New page: ==External links== [http://www.charmm.org/]
12:3612:36, 19 February 2007 diff hist +58‎ Nm NAMD ‎ New page: ==External links== [http://www.ks.uiuc.edu/Research/namd/]
12:3512:35, 19 February 2007 diff hist +51‎ Nm X-PLOR ‎ New page: ==External links== [http://atb.csb.yale.edu/xplor/]
12:3412:34, 19 February 2007 diff hist +1‎ m Materials modelling and computer simulation codes ‎No edit summary
12:3412:34, 19 February 2007 diff hist +46‎ m Materials modelling and computer simulation codes ‎No edit summary
12:3212:32, 19 February 2007 diff hist +46‎ Nm AMBER -- Assisted Model Building with Energy Refinement ‎ New page: ==External links== [http://amber.scripps.edu/]
12:3112:31, 19 February 2007 diff hist +60‎ m Materials modelling and computer simulation codes ‎No edit summary
12:2812:28, 19 February 2007 diff hist +45‎ Nm Gaussian (computer program) ‎ New page: ==External links== [http://www.gaussian.com/]
12:2712:27, 19 February 2007 diff hist +57‎ Nm DiMol2D ‎ New page: ==External links== [http://www.qft.iqfr.csic.es/DiMol2D/]
12:2512:25, 19 February 2007 diff hist +143‎ Nm Materials modelling and computer simulation codes ‎ New page: *DL_POLY Molecular Simulation Package *LAMMPS Molecular Dynamics Simulator *DiMol2D: Molecular Dynamics Visualization *Gaussian
12:2112:21, 19 February 2007 diff hist +401‎ m Researchers and research groups ‎No edit summary
12:0512:05, 19 February 2007 diff hist +49‎ m Main Page ‎No edit summary

21:0921:09, 17 February 2007 diff hist 0‎ m Lennard-Jones model ‎No edit summary
20:2920:29, 17 February 2007 diff hist −5‎ m Integral equations ‎No edit summary
20:2720:27, 17 February 2007 diff hist +77‎ m List of closures for integral equations ‎No edit summary
20:2620:26, 17 February 2007 diff hist +14‎ m Integral equations ‎No edit summary
20:2520:25, 17 February 2007 diff hist +19‎ m Equations of state ‎No edit summary
20:2420:24, 17 February 2007 diff hist +23‎ Nm Ideal gas ‎ New page: *Partition function
20:2320:23, 17 February 2007 diff hist +246‎ Nm Classical thermodynamics ‎ New page: *Zeroth law of thermodynamics *First law of thermodynamics *Second law of thermodynamics *Enthalpy *Helmholtz energy function *Gibbs energy function *[[Thermodynami...
20:2020:20, 17 February 2007 diff hist +123‎ m Statistical mechanics ‎No edit summary
20:1620:16, 17 February 2007 diff hist +441‎ Nm Born-Green equation ‎ New page: <math>kT \frac{\partial \ln g(r_{12})}{\partial r_1}= \frac{-\partial U(r_{12})}{\partial r_1}- \rho \int \left[ \frac{\partial U(r_{13})}{\partial r_1} \right] g(r_{13})g(r_{23}) ~ d r_...
20:0920:09, 17 February 2007 diff hist +66‎ Nm Statistical mechanics ‎ New page: *Kirkwood superposition approximation *Born-Green equation
20:0820:08, 17 February 2007 diff hist +638‎ Nm Kirkwood superposition approximation ‎ New page: Kirkwood 1935 (Eq. 40 \cite{JCP_1935_03_00300}, Eq. 5.6 \cite{PRSA_1946_188_0010}) <math>g_N^{(3)}(r_1,r_2,r_3)=g_N^{(2)}(r_1,r_2)g_N^{(2)}(r_2,r_3)g_N^{(2)}(r_3,r_1)</math> It appears t...
20:0320:03, 17 February 2007 diff hist +116‎ m Main Page ‎No edit summary
20:0020:00, 17 February 2007 diff hist +28‎ m Monte Carlo methods ‎No edit summary
19:5919:59, 17 February 2007 diff hist +104‎ m Models ‎No edit summary
19:3919:39, 17 February 2007 diff hist +68‎ Nm Perturbation theory ‎ New page: *Wertheim's first order thermodynamic perturbation theory (TPT1)
19:3719:37, 17 February 2007 diff hist +16‎ m Water ‎No edit summary
19:3619:36, 17 February 2007 diff hist +26‎ N Water ‎ Water moved to Water models
19:3619:36, 17 February 2007 diff hist 0‎ m Water models ‎ Water moved to Water models
19:3619:36, 17 February 2007 diff hist +53‎ m Researchers and research groups ‎No edit summary
19:2319:23, 17 February 2007 diff hist +285‎ m Biographies ‎No edit summary
19:1319:13, 17 February 2007 diff hist +72‎ Nm Daniel Bernoulli ‎ New page: Daniel Bernoulli (Groningen, February 8, 1700 – Basel, March 17, 1782)

21:4721:47, 16 February 2007 diff hist +263‎ m Researchers and research groups ‎No edit summary
21:2921:29, 16 February 2007 diff hist −7‎ m Carnahan-Starling equation of state ‎No edit summary
21:1221:12, 16 February 2007 diff hist +89‎ m Carnahan-Starling equation of state ‎ →‎References
21:0321:03, 16 February 2007 diff hist 0‎ m Models ‎No edit summary
21:0221:02, 16 February 2007 diff hist 0‎ m Hard sphere model ‎ Hard Sphere moved to Hard sphere
21:0021:00, 16 February 2007 diff hist +62‎ m SklogWiki:About ‎No edit summary
20:0320:03, 16 February 2007 diff hist +81‎ Nm User:Carl McBride ‎ New page: [http://www.qft.iqfr.csic.es/personal/carl/carlmcbride.html My home page is here]
19:2419:24, 16 February 2007 diff hist +26‎ m Lennard-Jones model ‎No edit summary
19:1119:11, 16 February 2007 diff hist +131‎ m Researchers and research groups ‎No edit summary
19:0919:09, 16 February 2007 diff hist +283‎ Nm Hard hexagon lattice model ‎ New page: Equation of state and isothermal compressibility for the hard hexagon model in the disordered regime. ==References== M P Richey and C A Tracy "Equation of state and isothermal compressibi...
19:0719:07, 16 February 2007 diff hist +85‎ m Integral equations ‎No edit summary
18:3218:32, 16 February 2007 diff hist +100‎ m Lennard-Jones model ‎No edit summary
18:2518:25, 16 February 2007 diff hist +24‎ Nm Monte Carlo methods ‎ New page: *Reverse Monte Carlo
18:1418:14, 16 February 2007 diff hist +1,298‎ m Hyper-netted chain ‎No edit summary
17:3317:33, 16 February 2007 diff hist +9‎ m Integral equations ‎No edit summary
17:3217:32, 16 February 2007 diff hist +55‎ Nm Hyper-netted chain ‎ New page: The HNC omits the Bridge function :<math>B(r) =0</math>
17:3117:31, 16 February 2007 diff hist +8‎ Nm Integral equations ‎ New page: *HNC
17:3117:31, 16 February 2007 diff hist +22‎ Nm Equations of state ‎ New page: *Carnahan-Starling
15:2915:29, 16 February 2007 diff hist +33‎ m SklogWiki:About ‎No edit summary
15:2815:28, 16 February 2007 diff hist +209‎ m SklogWiki:About ‎No edit summary
15:2115:21, 16 February 2007 diff hist +113‎ Nm SklogWiki:About ‎ New page: SklogWiki is a Wiki for the thermodynamics, statistical mechanics and computer simulation of materials community.
15:1915:19, 16 February 2007 diff hist +305‎ Nm Conferences ‎ New page: *[http://www.math.rutgers.edu/events/smm/res-formI.html 97th Statistical Mechanics Conference] MAY 6-8, 2007 RUTGERS UNIVERSITY *[http://thermo2007.ifp.fr Thermodynamics 2007] 26 - 28 Sept...
15:1515:15, 16 February 2007 diff hist 0‎ m Main Page ‎No edit summary
15:1215:12, 16 February 2007 diff hist +114‎ m Main Page ‎No edit summary
13:3813:38, 16 February 2007 diff hist +17‎ m Square well model ‎No edit summary
13:3713:37, 16 February 2007 diff hist +16‎ m Hard sphere model ‎No edit summary
11:5311:53, 16 February 2007 diff hist +94‎ Nm Johannes Diderik van der Waals ‎ New page: '''Johannes Diderik van der Waals''' (November 23, 1837 – March 8, 1923)
11:5311:53, 16 February 2007 diff hist +91‎ Nm Ludwig Eduard Boltzmann ‎ New page: '''Ludwig Eduard Boltzmann''' (February 20, 1844 – September 5, 1906)
11:5211:52, 16 February 2007 diff hist +65‎ m Biographies ‎No edit summary
11:5011:50, 16 February 2007 diff hist +113‎ Nm Josiah Willard Gibbs ‎ New page: '''Josiah Willard Gibbs''' (February 11, 1839 New Haven – April 28, 1903 New Haven)
11:5011:50, 16 February 2007 diff hist +2‎ m Biographies ‎No edit summary
11:5011:50, 16 February 2007 diff hist +25‎ m Biographies ‎No edit summary
11:4911:49, 16 February 2007 diff hist +80‎ Nm James Clerk Maxwell ‎ New page: '''James Clerk Maxwell''' (13 June 1831 – 5 November 1879)
11:4911:49, 16 February 2007 diff hist +23‎ Nm Biographies ‎ New page: James Clerk Maxwell
11:4711:47, 16 February 2007 diff hist +48‎ m Models ‎No edit summary
11:4711:47, 16 February 2007 diff hist +45‎ m Main Page ‎No edit summary
11:4211:42, 16 February 2007 diff hist +25‎ m Main Page ‎No edit summary

20:1420:14, 15 February 2007 diff hist +25‎ Nm List of closures for integral equations ‎ New page: *PY *HNC *MSV
20:0520:05, 15 February 2007 diff hist +47‎ Nm Water models ‎ New page: *SPC/E *TIP4P *TIP5P *TIP5P/Ice
20:0120:01, 15 February 2007 diff hist +37‎ Nm Monte Carlo ‎ New page: *Methods *Lattice Simulations
20:0120:01, 15 February 2007 diff hist +105‎ Nm Models ‎ New page: *Hard Sphere *Hard Ellipsoids *Square Well *Ramp *Gaussian Overlap *Lennard-Jones
19:5819:58, 15 February 2007 diff hist +176‎ N Main Page ‎ New page: *History *Models *Equations of State *Integral Equations *Monte Carlo *Molecular Dynamics *Water *Proteins *Research Groups *Conferences

User contributions for Carl McBride

2 March 2007

28 February 2007

27 February 2007

26 February 2007

23 February 2007

22 February 2007

21 February 2007

20 February 2007

19 February 2007

17 February 2007

16 February 2007

15 February 2007

Navigation menu

Search