From owner-chemistry@ccl.net Mon Jul 25 06:41:01 2011 From: "Avik Sanyal avik.sanyal#aci.uni-heidelberg.de" To: CCL Subject: CCL:G: Coulomb integral vs distance: how to plot this? Message-Id: <-45137-110725061321-12487-PJAWtyAU9It1tkWpbfaBHA() server.ccl.net> X-Original-From: "Avik Sanyal" Date: Mon, 25 Jul 2011 06:13:18 -0400 Sent to CCL by: "Avik Sanyal" [avik.sanyal[#]aci.uni-heidelberg.de] Dear CCL-ers, I wish to calculate the two-centre Coulomb repulsion integral (J_ab) as a function of distance (r). I am actually interested in the self Coulomb interaction energy of two atoms, which is the y-intercept of of the J_ab vs r plot. Any ideas on how I could obtain such a plot using standard QC packages (Gaussian, Jaguar etc)? Thanks in advance. Avik From owner-chemistry@ccl.net Mon Jul 25 08:55:00 2011 From: "Krati Joshi kjjulie.joshi\a/gmail.com" To: CCL Subject: CCL: Problem in preparing a proper input geometry for ONIOM calculations Message-Id: <-45138-110725063806-13225-0doRIZALcrdAlcOSKjjT9A]_[server.ccl.net> X-Original-From: "Krati Joshi" Date: Mon, 25 Jul 2011 06:38:03 -0400 Sent to CCL by: "Krati Joshi" [kjjulie.joshi%a%gmail.com] Dear all, I am working on Gausian 03 from last few months. Write now i am working on ONIOM calculations but i am facing a serious problem in it.Whenever i submit a job, it crashes after some time with an error message "Error in internal coordinates". It shows that there is some problem in my input geometry therefor i tried several times with different geometries but still i am not able to fix the problem.so pls suggest me if anybody knows how to prepare a proper input goemetry for ONIOM calculations.It will be of great help to me. Thanking You Krati Joshi Catalysis Division National Chemical laboratry,Dr. Homi Bhaba road Pune, India. Email,kjjulie.joshi-at-gmail.com From owner-chemistry@ccl.net Mon Jul 25 09:44:00 2011 From: "Eduardo edulsa_-_ufpr.br" To: CCL Subject: CCL: Free Crystal structure generator Message-Id: <-45139-110725091415-19956-7zAIA6Kqskj/51v0J6jqrQ]^[server.ccl.net> X-Original-From: Eduardo Content-Transfer-Encoding: 7bit Content-Type: text/plain; charset=ISO-8859-1; format=flowed Date: Mon, 25 Jul 2011 10:14:20 -0300 MIME-Version: 1.0 Sent to CCL by: Eduardo [edulsa^ufpr.br] Dear Utpal In a very long time ago, I used xcrysden (it is free, source code avaliable). I think it is a good option so that fill your necessities. Regards Eduardo On 07/17/11 03:52, Utpal Sarkar utpalchemiitkgp,,gmail.com wrote: > Dear CCL users, > Can you please suggest me some free software > using which I can generate ,say FCC (111) or BCC (100) plane with "M" > atoms along x-direction, "N" atoms along Y and "L" along Z? Using this > program I want to get the xyz-coordinate of the atoms. > Thanking you in advance > best regards > Utpal -- Eduardo Lemos de Sa Associated Professor at Chemistry Department Universidade Federal do Parana Dep. Quimica, P. Box 19081, 81531-990 Curitiba PR / Brazil phone: +55(41)33613300 fax : +55(41)33613186 From owner-chemistry@ccl.net Mon Jul 25 10:18:00 2011 From: "veera pandian ponnuchamy veera.pandi33===gmail.com" To: CCL Subject: CCL: Getting doubt on HOMO LUMO values Message-Id: <-45140-110725100329-28656-quXDoKIT0lD9i1OBw+XIBg%server.ccl.net> X-Original-From: "veera pandian ponnuchamy" Date: Mon, 25 Jul 2011 10:03:25 -0400 Sent to CCL by: "veera pandian ponnuchamy" [veera.pandi33-.-gmail.com] Dear CCLers, During optimization i got the following output Alpha occ. eigenvalues -- -0.30547 -0.29671 -0.29514 -0.28063 -0.26430 Alpha occ. eigenvalues -- -0.24087 -0.22966 -0.20713 Alpha virt. eigenvalues -- -0.09167 -0.06935 -0.04048 -0.03459 -0.01373 and Beta occ. eigenvalues -- -0.30049 -0.29603 -0.28833 -0.28042 -0.26428 Beta occ. eigenvalues -- -0.24077 -0.20692 Beta virt. eigenvalues -- -0.14610 -0.08220 -0.06905 -0.03649 -0.03277 my question is which value i should take for calculating HOMO and LUMO?(alpha or beta) Thanks in advance... From owner-chemistry@ccl.net Mon Jul 25 11:31:00 2011 From: "Gkourmpis, Thomas Thomas.Gkourmpis++borealisgroup.com" To: CCL Subject: CCL:G: Problem in preparing a proper input geometry for ONIOM calculations Message-Id: <-45141-110725094552-28941-swZKIusWQsiwSs6K+Ci8+A#server.ccl.net> X-Original-From: "Gkourmpis, Thomas" Content-Language: en-US Content-Transfer-Encoding: 8bit Content-Type: text/plain; charset="us-ascii" Date: Mon, 25 Jul 2011 15:45:41 +0200 MIME-Version: 1.0 Sent to CCL by: "Gkourmpis, Thomas" [Thomas.Gkourmpis_._borealisgroup.com] Joshi Hi The most common error people do when they're preparing ONIOM structures is either in the definition of the High and low level structures or in the connecting point between them. In Gaussian the program connects the two sections (high and low) via a dummy atom/bond (hydrogen). This atom has to be connected only to one atom and not more as the system cannot deal with it. I'm sorry I cannot be of more use to you but you don't really provide any information on how you're building the structure. Anyhow I would recommend you go through the review papers on the method by the relevant group that developed it as they're very good and they explain in detail how the method works. Hope it helps Thomas -----Original Message----- > From: owner-chemistry+thomas.gkourmpis==borealisgroup.com###ccl.net [mailto:owner-chemistry+thomas.gkourmpis==borealisgroup.com###ccl.net] On Behalf Of Krati Joshi kjjulie.joshia/gmail.com Sent: Monday, July 25, 2011 12:38 PM To: Gkourmpis, Thomas Subject: CCL: Problem in preparing a proper input geometry for ONIOM calculations Sent to CCL by: "Krati Joshi" [kjjulie.joshi%a%gmail.com] Dear all, I am working on Gausian 03 from last few months. Write now i am working on ONIOM calculations but i am facing a serious problem in it.Whenever i submit a job, it crashes after some time with an error message "Error in internal coordinates". It shows that there is some problem in my input geometry therefor i tried several times with different geometries but still i am not able to fix the problem.so pls suggest me if anybody knows how to prepare a proper input goemetry for ONIOM calculations.It will be of great help to me. Thanking You Krati Joshi Catalysis Division National Chemical laboratry,Dr. Homi Bhaba road Pune, India. Email,kjjulie.joshi-at-gmail.comhttp://www.ccl.net/cgi-bin/ccl/send_ccl_messagehttp://www.ccl.net/chemistry/sub_unsub.shtmlhttp://www.ccl.net/spammers.txtThis Email and any files transmitted with it are confidential and intended solely for the use of the individual or the entity to whom it is addressed. If you have received this Email by error, please notify the sender and delete the material from any storage device. Borealis extends no warranties and makes no representations as to the accuracy or completeness of the information provided. It is the customer's responsibility to inspect and test our products and technical advice in order to satisfy itself as to the suitability of the products and technical advice for the customer's particular purpose. From owner-chemistry@ccl.net Mon Jul 25 14:37:00 2011 From: "P.Canepa pc229 . kent.ac.uk" To: CCL Subject: CCL:G: J-ICE the 1st on-line viewer for Crystallographic and Electronic properties and OS independent Message-Id: <-45142-110725143521-29149-2BfhjfAtIk0rhyuld+gRaQ(_)server.ccl.net> X-Original-From: "P.Canepa" Content-Language: en-US Content-Type: multipart/alternative; boundary="_000_ECD17617547E4E138817CF2283EF3415kentacuk_" Date: Mon, 25 Jul 2011 19:35:11 +0100 MIME-Version: 1.0 Sent to CCL by: "P.Canepa" [pc229{}kent.ac.uk] --_000_ECD17617547E4E138817CF2283EF3415kentacuk_ Content-Type: text/plain; charset="us-ascii" Content-Transfer-Encoding: quoted-printable Dear All, I would like to share among you a graphic interface I have been working on= for a while called J-ICE. J-ICE is the 1st on-line viewer for Crystallogra= phic and Electronic properties. This interface is suited to deal with popul= ar condensed matter codes such as CRYSTAL, CASTEP, FHI-aims, GULP, Material= Studio, QuantumEspresso, VASP, WIEN2k, but also famous molecular programs l= ike GAUSSIAN, GROMACS and many other formats. Please, check it out here http://j-ice.sourceforge.net/ . Other main features of J-ICE : 1) free of cost 2) Operative system independent. It runs on WINDOWS, LINUX and Mac OSX 3) easy to use 4) 100 % compatible with Jmol Bests, Piero Please consider the environment before printing this e-mail. Pieremanuele Canepa Room 104 Functional Material Group School of Physical Sciences, Ingram Building, University of Kent, Canterbury, Kent, CT2 7NH United Kingdom e-mail: pc229#,#kent.ac.uk mobile: +44 (0) 772-9756456 ----------------------------------------------------------- --_000_ECD17617547E4E138817CF2283EF3415kentacuk_ Content-Type: text/html; charset="us-ascii" Content-Transfer-Encoding: quoted-printable
Dear All, 
I would like to share among you a graphic interface I  have been wor= king on for a while called J-ICE. J-ICE is the 1st on-line viewer for Cryst= allographic and Electronic properties. This interface is suited to deal wit= h popular condensed matter codes such as CRYSTAL, CASTEP, FHI-aims, GULP, M= aterialStudio, QuantumEspresso, VASP, WIEN2k, but also famous molecular pro= grams like GAUSSIAN, GROMACS and many other formats. 

Please, c= heck it out here http://j-ic= e.sourceforge.net/ .


Other main features of J-ICE :
=
1) free of cost 
2) Operative system independent. It runs on WI= NDOWS, LINUX and Mac OSX
3) easy to use 
4) 100 % compatible wit= h Jmol 

Bests, Piero


Please consider the environment before pri= nting this e-mail.

Pieremanuele Canepa
Room 104
Functiona= l Material Group
School of Physical Sciences, Ingram Building,
U= niversity of Kent, Canterbury, Kent,
CT2 7NH
United Kingdom
<= br>e-mail: pc229#,#kent.ac.ukmobile: +44 (0) 772-9756456
--------------------------------------= ---------------------

= --_000_ECD17617547E4E138817CF2283EF3415kentacuk_-- From owner-chemistry@ccl.net Mon Jul 25 15:11:00 2011 From: "Adam Tenderholt atenderholt*gmail.com" To: CCL Subject: CCL:G: admp and Mo Message-Id: <-45143-110725144655-22418-TFPeJ0+EdcouhC4YMZkPHg|a|server.ccl.net> X-Original-From: Adam Tenderholt Content-Transfer-Encoding: 8bit Content-Type: text/plain; charset=us-ascii Date: Mon, 25 Jul 2011 11:46:43 -0700 Mime-Version: 1.0 (Apple Message framework v1084) Sent to CCL by: Adam Tenderholt [atenderholt a gmail.com] Hi CCLers, I'm trying to run a ADMP calculation using Gaussian 03 and 09, but it keeps dying: -- TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ-TRJ IAtGet: Unknown atom type Error termination via Lnk1e in /usr/local/gauss09B/g09/l121.exe at Mon Jul 25 11:37:33 2011. Job cpu time: 0 days 0 hours 0 minutes 0.4 seconds. File lengths (MBytes): RWF= 5 Int= 0 D2E= 0 Chk= 1 Scr= 1 -- As near as I can tell, it has to do with the use of the Gen keyword which I've been using so that I can use different basis sets on different atoms (i.e. SDD for Mo, 6-311G(d) for S/O, and 6-31G(d) for C/H). Am I missing something? Is it possible to use the Gen and ADMP keywords together? Thanks, Adam From owner-chemistry@ccl.net Mon Jul 25 15:47:00 2011 From: "neranjan perera neranjan007_+_gmail.com" To: CCL Subject: CCL:G: Problem in preparing a proper input geometry for ONIOM calculations Message-Id: <-45144-110725134634-11601-mDOhVA78g9bRXxIRDFDMQw]![server.ccl.net> X-Original-From: neranjan perera Content-Type: multipart/alternative; boundary=000325554c86e0675404a8e864c6 Date: Mon, 25 Jul 2011 13:46:24 -0400 MIME-Version: 1.0 Sent to CCL by: neranjan perera [neranjan007]![gmail.com] --000325554c86e0675404a8e864c6 Content-Type: text/plain; charset=ISO-8859-1 Hi Krati Joshi, It would be helpful if you have provided at least a part of the output file to look into the matter. But most probably during ONIOM calculations, in gaussian it uses additional internal coordinates, to aid the optimization. What I am guessing is one of those values might have come closer to the maximum value, eg: angle coming closer to 180. so you may want to look at the angle/dihedral/distance which has an unreasonable value and can ask the program not to consider it, using the modredundent keyword. (more infor can be found in the webpage) hope it helps. Neranjan On Mon, Jul 25, 2011 at 9:45 AM, Gkourmpis, Thomas Thomas.Gkourmpis++ borealisgroup.com wrote: > > Sent to CCL by: "Gkourmpis, Thomas" [Thomas.Gkourmpis_._borealisgroup.com] > Joshi Hi > > The most common error people do when they're preparing ONIOM structures is > either in the definition of the High and low level structures or in the > connecting point between them. In Gaussian the program connects the two > sections (high and low) via a dummy atom/bond (hydrogen). This atom has to > be connected only to one atom and not more as the system cannot deal with > it. > > I'm sorry I cannot be of more use to you but you don't really provide any > information on how you're building the structure. Anyhow I would recommend > you go through the review papers on the method by the relevant group that > developed it as they're very good and they explain in detail how the method > works. > > Hope it helps > Thomas > > -----Original Message----- > > From: owner-chemistry+thomas.gkourmpis==borealisgroup.com:+:ccl.net[mailto: > owner-chemistry+thomas.gkourmpis==borealisgroup.com:+:ccl.net] On Behalf > Of Krati Joshi kjjulie.joshia/gmail.com > Sent: Monday, July 25, 2011 12:38 PM > To: Gkourmpis, Thomas > Subject: CCL: Problem in preparing a proper input geometry for ONIOM > calculations > > > Sent to CCL by: "Krati Joshi" [kjjulie.joshi%a%gmail.com] > Dear all, > I am working on Gausian 03 from last few months. Write > now i am working on ONIOM calculations but i am facing a serious > problem in it.Whenever i submit a job, it crashes after some time with > an error message "Error in internal coordinates". It shows that there > is some problem in my input geometry therefor i tried several times with > different geometries but still i am not able to fix the problem.so pls > suggest me if anybody knows how to prepare a proper input goemetry for > ONIOM calculations.It will be of great help to me. > Thanking You > Krati Joshi > Catalysis Division National Chemical laboratry,Dr. Homi Bhaba road Pune, > India. > Email,kjjulie.joshi-at-gmail.comhttp:// > www.ccl.net/cgi-bin/ccl/send_ccl_messagehttp://www.ccl.net/chemistry/sub_unsub.shtmlhttp://www.ccl.net/spammers.txtThisEmail and any files transmitted with it are confidential and > intended solely for the use of the individual or the entity to whom > it is addressed. If you have received this Email by error, please > notify the sender and delete the material from any storage device. > Borealis extends no warranties and makes no representations as to > the accuracy or completeness of the information provided. It is the > customer's responsibility to inspect and test our products and > technical advice in order to satisfy itself as to the suitability > of the products and technical advice for the customer's particular > purpose.> > > -- Neranjan Perera Graduate Student --000325554c86e0675404a8e864c6 Content-Type: text/html; charset=ISO-8859-1 Content-Transfer-Encoding: quoted-printable Hi Krati Joshi,
=A0=A0=A0 It would be helpful if you have provided at le= ast a part of the output file to look into the matter. But most probably du= ring ONIOM calculations, in gaussian it uses additional internal coordinate= s, to aid the optimization.
=A0=A0=A0 What I am guessing is one of those values might have come closer = to the maximum value,
eg: angle coming closer to 180.

so you may= want to look at the angle/dihedral/distance which has an unreasonable valu= e and can ask the program not to consider it, using the modredundent keywor= d. (more infor can be found in the webpage)

hope it helps.

Neranjan
=A0=A0

On Mon, Jul 25, 2011 at 9:45 AM, Gkourmpis, Thomas Thomas.Gkourmpis++= borealisgroup.com <owner-chemistry^ccl.net> wrote:

Sent to CCL by: "Gkourmpis, Thomas" [Thomas.Gkourmpis_._borealisgroup.com]
Joshi Hi

The most common error people do when they're preparing ONIOM structures= is either in the definition of the High and low level structures or in the= connecting point between them. In Gaussian the program connects the two se= ctions (high and low) via a dummy atom/bond (hydrogen). This atom has to be= connected only to one atom and not more as the system cannot deal with it.=

I'm sorry I cannot be of more use to you but you don't really provi= de any information on how you're building the structure. Anyhow I would= recommend you go through the review papers on the method by the relevant g= roup that developed it as they're very good and they explain in detail = how the method works.

Hope it helps
Thomas

-----Original Message-----
> From: owner-chemistry+thomas.gkourmpis=3D=3Dborealisgroup.com:+:ccl.net [mailto:owner-chemistry+thomas.gkourmpis= =3D=3Dborealisgroup.com:+:ccl.= net] On Behalf Of Krati Joshi kjjulie.joshia/gmail.com
Sent: Monday, July 25, 2011 12:38 PM
To: Gkourmpis, Thomas
Subject: CCL: Problem in preparing a proper input geometry for ONIOM calcul= ations


Sent to CCL by: "Krati =A0Joshi" [kjjulie.joshi%a%gmail.com]
Dear all,
=A0 =A0 =A0 =A0 =A0 =A0I am working on Gausian 03 from last few months. Wr= ite
now i am working on ONIOM calculations but i am facing a serious
problem in it.Whenever i submit =A0a job, it crashes after some time with an error message "Error in internal coordinates". It shows that t= here
is some problem in my input geometry therefor i tried several times with different geometries but still i am not able to fix the problem.so pls =A0s= uggest me if anybody knows how to prepare a proper input goemetry for ONIOM= calculations.It will be of great help to me.
Thanking You
Krati Joshi
Catalysis Division National Chemical laboratry,Dr. Homi Bhaba road Pune, In= dia.
Email,kjjulie.joshi-at-gmail.comhttp://www.ccl.net/cgi-bin/ccl/send_= ccl_messagehttp://www.ccl.net/chemistry/sub_unsub.shtmlhttp://www.ccl.net/s= pammers.txtThis Email and any files transmitted with it are confidentia= l and
intended solely for the use of the individual or the entity to whom
it is addressed. If you have received this Email by error, please
notify the sender and delete the material from any storage device.
Borealis extends no warranties and makes no representations as to
the accuracy or completeness of the information provided. It is the
customer's responsibility to inspect and test our products and
technical advice in order to satisfy itself as to the suitability
of the products and technical advice for the customer's particular
purpose.



-=3D This is automatically added to each message by the mailing script =3D-=
E-mail to subscribers: CHEMISTRY^ccl.n= et or use:
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--
Neranjan Perera
Graduate Student

--000325554c86e0675404a8e864c6-- From owner-chemistry@ccl.net Mon Jul 25 16:27:00 2011 From: "Mandegar Syavash mandegar_saman]![yahoo.com" To: CCL Subject: CCL:G: G09: How to modify a link in G09 Message-Id: <-45145-110725162549-24658-TuYrBG8SHxVF/H7W2Kq+Yw _ server.ccl.net> X-Original-From: "Mandegar Syavash" Date: Mon, 25 Jul 2011 16:25:45 -0400 Sent to CCL by: "Mandegar Syavash" [mandegar_saman||yahoo.com] Dear All, Does any body know any documentation about modifying links in Gaussian09. I am interested in modifying a link in G09. But I don't know how to make the object file for that modified link. Any tip is greatly acknowledged. Regards, Syavash From owner-chemistry@ccl.net Mon Jul 25 17:09:01 2011 From: "Eliac Brown Eliacbrown],[yahoo.com" To: CCL Subject: CCL: Charge - Accuracy Message-Id: <-45146-110725054234-15910-UNx87URgxW7cVfCZQnK2iA---server.ccl.net> X-Original-From: "Eliac Brown" Date: Mon, 25 Jul 2011 05:42:32 -0400 Sent to CCL by: "Eliac Brown" [Eliacbrown- -yahoo.com] Dear ALL I calculated the atomic partial charges for my small molecule using two different methods. The two methods generated charges so close to each other. I want to test the accuracy of the generated charges of the two tested methods and compare to each other, to select the best method of charge calculation. I studied dipolemoment and interaction energy (with substrates) of the molecule. I was wondering what other criteria/properties/calculation should I test to evaluate the generated charges. All the calculations are molecular mechanical using AMBER Thanks, Eliac From owner-chemistry@ccl.net Mon Jul 25 21:08:00 2011 From: "DeJong, Wibe A Wibe.DeJong _ pnnl.gov" To: CCL Subject: CCL: Access to basis set in bse portal Message-Id: <-45147-110725201041-13697-wXyCtGP3xji3lkSM5J/xXA*server.ccl.net> X-Original-From: "DeJong, Wibe A" Content-Language: en-US Content-Type: multipart/alternative; boundary="_000_EC1BA8FE1D2F8A48802158E031C190110102C78B6537EMAIL05pnlg_" Date: Mon, 25 Jul 2011 17:10:20 -0700 MIME-Version: 1.0 Sent to CCL by: "DeJong, Wibe A" [Wibe.DeJong * pnnl.gov] --_000_EC1BA8FE1D2F8A48802158E031C190110102C78B6537EMAIL05pnlg_ Content-Type: text/plain; charset="us-ascii" Content-Transfer-Encoding: quoted-printable Dear community, The Basis Set Exchange portal (BSE, bse.pnl.gov) is fully operational agai= n. Thanks, Bert > From: owner-chemistry+bert.dejong=3D=3Dpnl.gov|*|ccl.net [mailto:owner-chemis= try+bert.dejong=3D=3Dpnl.gov|*|ccl.net] On Behalf Of Marcus Vinicius Pereira = dos Santos bossanova90^yahoo.com Sent: Thursday, July 21, 2011 4:49 AM To: DeJong, Wibe A Subject: CCL: Access to basis set in bse portal Dear community, I try to download some basis sets in the Basis Set Exchange (BSE) portal w= ithout success. When I try, I got the following error: ; nested exception is: javax.net.ssl.SSLHandshakeException: sun.security.validator.Validator= Exception: Certificate chaining error I tried using different OS, different browsers but the problem still remain= . Has everyone knows what's going on? Yet, Is there other websites where I = can get basis set? Thank you, Marcus Santos PhD Student - Materials Science Universidade Federal de Pernambuco Recife - Pernambuco - Brazil --_000_EC1BA8FE1D2F8A48802158E031C190110102C78B6537EMAIL05pnlg_ Content-Type: text/html; charset="us-ascii" Content-Transfer-Encoding: quoted-printable

Dear community,

 

The Basis Set Exch= ange portal  (BSE, bse.pnl.gov) is fully operational again.

 

Thanks,

 

Bert<= /span>

 

From: owner-chemistry+bert.dejong=3D=3Dpnl.gov|*|ccl.= net [mailto:owner-chemistry+bert.dejong=3D=3Dpnl.gov|*|ccl.net] On Behalf = Of Marcus Vinicius Pereira dos Santos bossanova90^yahoo.com
Sent:= Thursday, July 21, 2011 4:49 AM
To: DeJong, Wibe A
Sub= ject: CCL: Access to basis set in bse portal

 

Dear = community,

 

I try to download some basis sets in the Basis= Set Exchange (BSE) portal  without success. When I try, I got the fol= lowing error:

 

; nested exception is: 
    =
;  javax.net.ssl.SSLHandshakeException: sun.security.validator.Validat=
orException: Certificate chaining error

 

I = tried using different OS, different browsers but the problem still remain. = Has everyone knows what's going on? Yet, Is there other websites where I ca= n get basis set?

 <= /o:p>

 

Thank you,

 

 

=

Marcus Santos

PhD Student - Materials Science

<= p class=3DMsoNormal>Universidade Federal de Pernambuco

=

Recife - Pernambuco - Brazil

=
= --_000_EC1BA8FE1D2F8A48802158E031C190110102C78B6537EMAIL05pnlg_--