From 03cb7870255e86f2bb801b6553258ec9e70cc79f Mon Sep 17 00:00:00 2001 From: sjplimp Date: Tue, 10 May 2016 14:39:05 +0000 Subject: [PATCH] git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14983 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- doc/html/fix_pimd.html | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/doc/html/fix_pimd.html b/doc/html/fix_pimd.html index 9fd1a77fa6..57ee90e294 100644 --- a/doc/html/fix_pimd.html +++ b/doc/html/fix_pimd.html @@ -171,7 +171,7 @@ index (the second term in the effective potential above). The quasi-beads also interact with the two neighboring quasi-beads through the spring potential in imaginary-time space (first term in effective potential). To sample the canonical ensemble, a Nose-Hoover massive -chain thermostat is applied (Tuckerman). With the +chain thermostat is applied (Tuckerman). With the massive chain algorithm, a chain of NH thermostats is coupled to each degree of freedom for each quasi-bead. The keyword temp sets the target temperature for the system and the keyword nhc sets the @@ -271,7 +271,7 @@ and nhc = 2.


(Feynman) R. Feynman and A. Hibbs, Chapter 7, Quantum Mechanics and Path Integrals, McGraw-Hill, New York (1965).

-

(Tuckerman) M. Tuckerman and B. Berne, J Chem Phys, 99, 2796 (1993).

+

(Tuckerman) M. Tuckerman and B. Berne, J Chem Phys, 99, 2796 (1993).

(Cao1) J. Cao and B. Berne, J Chem Phys, 99, 2902 (1993).

(Cao2) J. Cao and G. Voth, J Chem Phys, 100, 5093 (1994).

(Hone) T. Hone, P. Rossky, G. Voth, J Chem Phys, 124,