From owner-chemistry@ccl.net Sat Jan 11 11:43:01 2014 From: "Partha Sengupta anapspsmo._._.gmail.com" To: CCL Subject: CCL:G: MOLDEN in Windows 7. Message-Id: <-49536-140111111452-17542-9NnlD1fKGxQdjAbka0ZSLQ_._server.ccl.net> X-Original-From: Partha Sengupta Content-Type: multipart/alternative; boundary=047d7b6dba6c14b16804efb4248d Date: Sat, 11 Jan 2014 21:44:45 +0530 MIME-Version: 1.0 Sent to CCL by: Partha Sengupta [anapspsmo[A]gmail.com] --047d7b6dba6c14b16804efb4248d Content-Type: text/plain; charset=ISO-8859-1 Please help me to draw the NBO, NMMO in Windows 7 system. I want to use MOLDEN. But unable to install this software in my computing system. I use Gaussian 09w. Please help to overcome the problem.It will be beneficiary to me if the installation and working procedure be stated in sequentially. I have no idea about Fortran, Java, Unix and Linux system. Partha S Sengupta -- Dr. Partha Sarathi Sengupta Associate Professor Vivekananda Mahavidyalaya, Burdwan --047d7b6dba6c14b16804efb4248d Content-Type: text/html; charset=ISO-8859-1 Content-Transfer-Encoding: quoted-printable
Please help me to draw the NBO,=A0 NMMO in Windo= ws 7 system. I want to use MOLDEN. But unable to install this software in m= y computing system. I use Gaussian 09w. Please help to overcome the problem= .It will be beneficiary to me if the installation and working procedure be = stated in sequentially.
I have no idea about Fortran, Java, Unix and Linux system.
<= div>Partha S Sengupta=A0

--
= Dr. Partha Sarathi Sengupta
Associate Professor
Vivekananda Mahavidya= laya, Burdwan
--047d7b6dba6c14b16804efb4248d-- From owner-chemistry@ccl.net Sat Jan 11 17:12:01 2014 From: "Julio Dominguez acheron24 * hotmail.com" To: CCL Subject: CCL:G: MOLDEN in Windows 7. Message-Id: <-49537-140111165140-645-NjblqZL+k7zjQU36+ZF/sA]|[server.ccl.net> X-Original-From: Julio Dominguez Content-Type: multipart/alternative; boundary="_c1081028-dbfb-4c5e-90c7-0374807244c3_" Date: Sat, 11 Jan 2014 21:51:34 +0000 MIME-Version: 1.0 Sent to CCL by: Julio Dominguez [acheron24() hotmail.com] --_c1081028-dbfb-4c5e-90c7-0374807244c3_ Content-Type: text/plain; charset="iso-8859-1" Content-Transfer-Encoding: quoted-printable So=2C Windows 7. You need a copy of molden for windows. Then=2C you need an X11 server. The = one I know that is free and works with molden is Xming: http://www.straight= running.com/XmingNotes/ http://sourceforge.net/projects/xming/files/Xming/6.9.0.31/Xming-6-9-0-31-s= etup.exe/download Install Xming=2C then double click Molden. That is it. > From: owner-chemistry%x%ccl.net To: acheron24%x%hotmail.com Subject: CCL:G: MOLDEN in Windows 7. Date: Sat=2C 11 Jan 2014 21:44:45 +0530 Please help me to draw the NBO=2C NMMO in Windows 7 system. I want to use = MOLDEN. But unable to install this software in my computing system. I use G= aussian 09w. Please help to overcome the problem.It will be beneficiary to = me if the installation and working procedure be stated in sequentially. =0A= I have no idea about Fortran=2C Java=2C Unix and Linux system. Partha S Sengupta =20 --=20 Dr. Partha Sarathi Sengupta Associate Professor Vivekananda Mahavidyalaya=2C Burdwan=0A= = --_c1081028-dbfb-4c5e-90c7-0374807244c3_ Content-Type: text/html; charset="iso-8859-1" Content-Transfer-Encoding: quoted-printable


So=2C= Windows 7.

You need a copy of molden for windows. Then= =2C you need an X11 server. The one I know that is free and works with mold= en is Xming: =3Bhttp://www.straightrunning.com/XmingNotes/
=

Install Xming=2C then double click Molde= n. That is it.

From: owner-chemi= stry%x%ccl.net
To: acheron24%x%hotmail.com
Subject: CCL:G: MOLDEN in Wind= ows 7.
Date: Sat=2C 11 Jan 2014 21:44:45 +0530

<= div>
Please help me to draw the NBO=2C =3B NMMO in Windows 7 system= . I want to use MOLDEN. But unable to install this software in my computing= system. I use Gaussian 09w. Please help to overcome the problem.It will be= beneficiary to me if the installation and working procedure be stated in s= equentially.
=0A=
I have no idea about Fortran=2C Java=2C Unix and Linux system.
Partha S Sengupta =3B
--
Dr. Partha Sarathi Sengupta
Associate Professor
Vivekananda = Mahavidyalaya=2C Burdwan=0A=
= --_c1081028-dbfb-4c5e-90c7-0374807244c3_-- From owner-chemistry@ccl.net Sat Jan 11 18:29:00 2014 From: "Jim Kress ccl_nospam-.-kressworks.com" To: CCL Subject: CCL:G: MOLDEN in Windows 7. Message-Id: <-49538-140111182443-1248-fCMs9XPa4Cghd7bqLtWL5g/a\server.ccl.net> X-Original-From: "Jim Kress" Content-Language: en-us Content-Type: multipart/alternative; boundary="----=_NextPart_000_0129_01CF0EFA.58224ED0" Date: Sat, 11 Jan 2014 18:24:19 -0500 MIME-Version: 1.0 Sent to CCL by: "Jim Kress" [ccl_nospam##kressworks.com] This is a multipart message in MIME format. ------=_NextPart_000_0129_01CF0EFA.58224ED0 Content-Type: text/plain; charset="us-ascii" Content-Transfer-Encoding: 7bit Unless you have a unique reason to use MOLDEN on Windows, you'd be better off using ChemCraft or other similar native Win 7 visualization software. http://www.chemcraftprog.com/ Others: http://nortonsafe.search.ask.com/web?q=NBO+visualization+software &o=APN10505&prt=360&chn=retail&geo=US&ver=20&locale=en_US&tpr=111&gct=sb&qsr c=2869 Jim > From: owner-chemistry+ccl_nospam==kressworks.com!A!ccl.net [mailto:owner-chemistry+ccl_nospam==kressworks.com!A!ccl.net] On Behalf Of Partha Sengupta anapspsmo.!A!.gmail.com Sent: Saturday, January 11, 2014 11:15 AM To: Kress, Jim Subject: CCL:G: MOLDEN in Windows 7. Please help me to draw the NBO, NMMO in Windows 7 system. I want to use MOLDEN. But unable to install this software in my computing system. I use Gaussian 09w. Please help to overcome the problem.It will be beneficiary to me if the installation and working procedure be stated in sequentially. I have no idea about Fortran, Java, Unix and Linux system. Partha S Sengupta -- Dr. Partha Sarathi Sengupta Associate Professor Vivekananda Mahavidyalaya, Burdwan ------=_NextPart_000_0129_01CF0EFA.58224ED0 Content-Type: text/html; charset="us-ascii" Content-Transfer-Encoding: quoted-printable

Unless you have a unique reason to use MOLDEN on Windows, you’d = be better off using ChemCraft or other similar native Win 7 = visualization software.

 

http://www.chemcraftprog.com/<= span style=3D'color:#1F497D'>

Others:

http://= nortonsafe.search.ask.com/web?q=3DNBO+visualization+software&o=3DAPN1= 0505&prt=3D360&chn=3Dretail&geo=3DUS&ver=3D20&locale=3D= en_US&tpr=3D111&gct=3Dsb&qsrc=3D2869

 

Jim

 

From: = owner-chemistry+ccl_nospam=3D=3Dkressworks.com!A!ccl.net = [mailto:owner-chemistry+ccl_nospam=3D=3Dkressworks.com!A!ccl.net] On = Behalf Of Partha Sengupta anapspsmo.!A!.gmail.com
Sent: = Saturday, January 11, 2014 11:15 AM
To: Kress, Jim =
Subject: CCL:G: MOLDEN in Windows = 7.

 

Please help me to draw the NBO,  NMMO in Windows = 7 system. I want to use MOLDEN. But unable to install this software in = my computing system. I use Gaussian 09w. Please help to overcome the = problem.It will be beneficiary to me if the installation and working = procedure be stated in sequentially.

I have no idea about Fortran, Java, Unix and Linux = system.

Partha S = Sengupta 


--
Dr. Partha Sarathi Sengupta
Associate = Professor
Vivekananda Mahavidyalaya, Burdwan =

------=_NextPart_000_0129_01CF0EFA.58224ED0-- From owner-chemistry@ccl.net Sat Jan 11 20:11:00 2014 From: "Tian Lu sobereva]-[sina.com" To: CCL Subject: CCL:G: MOLDEN in Windows 7. Message-Id: <-49539-140111180146-23271-aN0TkxQr6E1QwmMmFTEXFA-#-server.ccl.net> X-Original-From: "Tian Lu" Date: Sat, 11 Jan 2014 18:01:45 -0500 Sent to CCL by: "Tian Lu" [sobereva|-|sina.com] Dear Partha, There are two alternative and better ways to plot NBO and NLMO in Win7. (1) Using pop=saveNBO and pop=saveNLMO to save NBO and NLMO respectively into .chk file and then convert it to .fch file. After that you can use GaussView or Multiwfn (freely available at http://multiwfn.codeplex.com) to load the .fch file and visualize them. (2) Using pop=nboread keyword to generate NBO plot files, then use Multiwfn to load them and visualize NBO and NLMO. An example of quick visualization of NBO (or NAO, NHO, NLMO and their "pre-" versions) in Multiwfn can be found in Section 4.0.2 of its manual. In addition, by using main function 3 and 4 of Multiwfn the orbitals can also be conveniently plotted as curve map and plane map (contour, color-filled and relief maps, see Section 4.4.5 for example). Best wishes, Tian Lu Department of Chemistry and Chemical Engineering University of Science and Technology Beijing, Beijing, P. R. China mailto: sobereva[a]sina.com ----- Original Message ----- > From: "Partha Sengupta anapspsmo.[a].gmail.com" To: "Lu, Tian " Subject: CCL:G: MOLDEN in Windows 7. Date: 2014-01-12 00:14 Please help me to draw the NBO, NMMO in Windows 7 system. I want to use MOLDEN. But unable to install this software in my computing system. I use Gaussian 09w. Please help to overcome the problem.It will be beneficiary to me if the installation and working procedure be stated in sequentially. I have no idea about Fortran, Java, Unix and Linux system. Partha S Sengupta -- Dr. Partha Sarathi Sengupta Associate Professor Vivekananda Mahavidyalaya, Burdwan