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dfee4bd 2013-07-18 12:14:02 Katsuhiko Nishimra

Implement the serializer for MolDSException. #31716

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1404 1136aad2-a195-0410-b898-f5ea1d11b9d8
11b4790 2013-07-18 00:25:27 Mikiya Fujii

Supporing Boost-1.46.0 #31728

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1403 1136aad2-a195-0410-b898-f5ea1d11b9d8
071d6ae 2013-07-17 13:28:26 Katsuhiko Nishimra

Include iostream in Moldsexception.cpp temprarily. #31491

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1402 1136aad2-a195-0410-b898-f5ea1d11b9d8
81b0891 2013-07-17 13:01:05 Mikiya Fujii

-lboost_serialization is added to make files. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1401 1136aad2-a195-0410-b898-f5ea1d11b9d8
8b6e558 2013-07-17 02:01:10 Mikiya Fujii

Small methods in Cndo2-class are inlined. #30621

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1400 1136aad2-a195-0410-b898-f5ea1d11b9d8
05e6f3e 2013-07-17 01:31:37 Mikiya Fujii

Small methods in Molecule are inlined. #30621

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1399 1136aad2-a195-0410-b898-f5ea1d11b9d8
4a32626 2013-07-16 23:56:46 Mikiya Fujii

OpenMP report in compiling was disappeared.

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1398 1136aad2-a195-0410-b898-f5ea1d11b9d8
8be3882 2013-07-16 16:52:56 Katsuhiko Nishimra

Merge source files of trunk into branch automake. #28588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/automake@1397 1136aad2-a195-0410-b898-f5ea1d11b9d8
b6fc3ef 2013-07-14 08:13:41 Katsuhiko Nishimra

Copyright notations are updated.

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1396 1136aad2-a195-0410-b898-f5ea1d11b9d8
ef56b3e 2013-07-12 20:24:29 Mikiya Fujii

Merge mpi-cis into trunk. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1395 1136aad2-a195-0410-b898-f5ea1d11b9d8
95da890 2013-07-12 20:23:58 Mikiya Fujii

Merge mpi-cis into trunk. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1394 1136aad2-a195-0410-b898-f5ea1d11b9d8
e11f00f svn/mpi-cis 2013-07-12 20:01:34 Mikiya Fujii

Merge trunk into branch mpi-cis. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1393 1136aad2-a195-0410-b898-f5ea1d11b9d8
0e7b587 2013-07-12 19:51:09 Mikiya Fujii

README is updated for compiling. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1392 1136aad2-a195-0410-b898-f5ea1d11b9d8
0760324 2013-07-12 19:30:22 Mikiya Fujii

README is updated for MPI running. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1391 1136aad2-a195-0410-b898-f5ea1d11b9d8
dc46d31 2013-07-12 19:16:43 Mikiya Fujii

Tests of MPI for cis are added #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1390 1136aad2-a195-0410-b898-f5ea1d11b9d8
8560657 2013-07-12 18:54:02 Katsuhiko Nishimra

Fix test code.

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1389 1136aad2-a195-0410-b898-f5ea1d11b9d8
4e91aae 2013-07-12 15:59:42 Mikiya Fujii

Too big messages are split to be send by MPI. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1388 1136aad2-a195-0410-b898-f5ea1d11b9d8
dc72042 2013-07-12 15:12:25 Mikiya Fujii

Inputmodule of MPI is deleted. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1387 1136aad2-a195-0410-b898-f5ea1d11b9d8
d9d632c 2013-07-12 13:15:27 Katsuhiko Nishimra

Don't take DIIS step if DIIS matrix is singular. #30595

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1386 1136aad2-a195-0410-b898-f5ea1d11b9d8
da0cf79 2013-07-12 13:15:23 Katsuhiko Nishimra

Add LapackInfo key value pair into Exception. #31712

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1385 1136aad2-a195-0410-b898-f5ea1d11b9d8
c5dfc4f 2013-07-12 13:15:16 Katsuhiko Nishimra

Add key value storage in MolDSException. #31712

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/trunk@1384 1136aad2-a195-0410-b898-f5ea1d11b9d8
d5aaabf 2013-07-12 10:51:39 Mikiya Fujii

Makefir for GNU is updated. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1383 1136aad2-a195-0410-b898-f5ea1d11b9d8
ce7ed51 2013-07-11 23:07:01 Mikiya Fujii

Makefile for INTEL is updated. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1382 1136aad2-a195-0410-b898-f5ea1d11b9d8
6a2c5ad 2013-07-11 19:53:42 Mikiya Fujii

Makefile for INTEL is updated. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1381 1136aad2-a195-0410-b898-f5ea1d11b9d8
f665026 2013-07-11 19:32:30 Mikiya Fujii

README.txt is updated. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1380 1136aad2-a195-0410-b898-f5ea1d11b9d8
da6e5d9 2013-07-11 18:03:26 Mikiya Fujii

Input module of message-limit in MPI is added. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1379 1136aad2-a195-0410-b898-f5ea1d11b9d8
b34360b 2013-07-11 17:28:48 Mikiya Fujii

Including header-file is arragned. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1378 1136aad2-a195-0410-b898-f5ea1d11b9d8
0f8336a 2013-07-11 15:13:36 Mikiya Fujii

Rapper of MPI-broadcast is added. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1377 1136aad2-a195-0410-b898-f5ea1d11b9d8
e0614f5 2013-07-11 14:09:44 Mikiya Fujii

MNDO uses rappers of MPI-send and recv. Besides, a bug about broadcast is fixed. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1376 1136aad2-a195-0410-b898-f5ea1d11b9d8
6143ac1 2013-07-10 19:30:05 Mikiya Fujii

Rappers of MPI-send and recv are added. #31588

git-svn-id: https://svn.sourceforge.jp/svnroot/molds/branches/mpi-cis@1375 1136aad2-a195-0410-b898-f5ea1d11b9d8