<?xml version='1.0' encoding='UTF-8'?><?xml-stylesheet href="http://www.blogger.com/styles/atom.css" type="text/css"?><feed xmlns='http://www.w3.org/2005/Atom' xmlns:openSearch='http://a9.com/-/spec/opensearchrss/1.0/' xmlns:blogger='http://schemas.google.com/blogger/2008' xmlns:georss='http://www.georss.org/georss' xmlns:gd="http://schemas.google.com/g/2005" xmlns:thr='http://purl.org/syndication/thread/1.0'><id>tag:blogger.com,1999:blog-4642350417253823263</id><updated>2020-06-08T00:47:45.515-07:00</updated><category term="tips and tricks"/><category term="how to"/><category term="journals"/><category term="publications"/><category term="research proposal"/><category term="ACS"/><category term="CASTEP"/><category term="JACS"/><category term="London"/><category term="SciFinder"/><category term="Web of Knowledge"/><category term="article reviews"/><category term="chem"/><category term="dmol"/><category term="examples"/><category term="holidays"/><category term="nature"/><category term="science"/><category term="simulations"/><category term="vacation"/><category term="vasp"/><category term="website review"/><title type='text'>Chemical Simulations   - reading, writing &amp; researching Chemistry</title><subtitle type='html'>Scientific reading, writing, software (dmol, CASTEP, VASP and MORE!)</subtitle><link rel='http://schemas.google.com/g/2005#feed' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/posts/default'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default?redirect=false'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/'/><link rel='hub' href='http://pubsubhubbub.appspot.com/'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><generator version='7.00' uri='http://www.blogger.com'>Blogger</generator><openSearch:totalResults>10</openSearch:totalResults><openSearch:startIndex>1</openSearch:startIndex><openSearch:itemsPerPage>25</openSearch:itemsPerPage><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-3434629691971161433</id><published>2013-05-19T09:33:00.001-07:00</published><updated>2013-05-19T09:33:16.618-07:00</updated><title type='text'>Introduction to Chemical Simulations (Materials Studio)</title><summary type="text">
Hello Guys,

I thought this simple video provides some illustration to what chemical simulations look like. This video focuses on the Materials Studio software and showcase the basic functions as well as some high level ones such as the &#39;reaction preview&#39; to visualize the process of a chemical reaction.

Cheers~

JohnHD



</summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/3434629691971161433/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2013/05/introduction-to-chemical-simulations.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/3434629691971161433'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/3434629691971161433'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2013/05/introduction-to-chemical-simulations.html' title='Introduction to Chemical Simulations (Materials Studio)'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-7977282118754809336</id><published>2013-05-19T09:20:00.002-07:00</published><updated>2013-05-19T09:28:21.411-07:00</updated><title type='text'>Sights in London</title><summary type="text">Hello readers,

I have been really busy these couple of months and I have neglected to make updates. I am hoping the next quarter would be better so I can properly update the site and put up some specific articles. Anyhow, I am putting up some pictures that I took during my earlier trip. It was a pleasant memory with beautiful scenery. I would love to go back there for a long vacation. 

Enjoy!

</summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/7977282118754809336/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2013/05/sights-in-london.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/7977282118754809336'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/7977282118754809336'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2013/05/sights-in-london.html' title='Sights in London'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><media:thumbnail xmlns:media="http://search.yahoo.com/mrss/" url="http://4.bp.blogspot.com/-pwB1HDZYCwE/UNlvMbj8HRI/AAAAAAAAAC8/8Z5A6ZQginw/s72-c/IMG_0343.JPG" height="72" width="72"/><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-7940752544419109058</id><published>2012-12-25T04:45:00.004-08:00</published><updated>2012-12-26T00:02:02.170-08:00</updated><category scheme="http://www.blogger.com/atom/ns#" term="holidays"/><category scheme="http://www.blogger.com/atom/ns#" term="London"/><category scheme="http://www.blogger.com/atom/ns#" term="vacation"/><title type='text'>Christmas Greetings : London</title><summary type="text">Hello folks,

A very merry Christmas and happy New Year to all! As you may be realized, I have not posted in a while. I&#39;ve been busy with some projects and I also did some travelling. Following that, the festive preparations and celebrations kept me busy and I suspect for some more time. :D

London is a beautiful city with truly friendly and honorable people. At the same time, it is also one of </summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/7940752544419109058/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2012/12/christmas-greetings-london.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/7940752544419109058'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/7940752544419109058'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2012/12/christmas-greetings-london.html' title='Christmas Greetings : London'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-5727098239666740535</id><published>2012-11-18T08:49:00.003-08:00</published><updated>2012-11-23T19:24:49.607-08:00</updated><category scheme="http://www.blogger.com/atom/ns#" term="how to"/><category scheme="http://www.blogger.com/atom/ns#" term="journals"/><category scheme="http://www.blogger.com/atom/ns#" term="publications"/><category scheme="http://www.blogger.com/atom/ns#" term="research proposal"/><category scheme="http://www.blogger.com/atom/ns#" term="tips and tricks"/><title type='text'>How to get your work published...on high impact journals (Part II)</title><summary type="text">


Heya folks,



In the previous post, we talked the importance of having original content if anyone wants to have a paper published. And its very important indeed. No one would want to read magazines with similar content by different authors page after page.



But .... why are some journals more &#39;popular&#39; or of &#39;higher impact&#39; than others? What makes people pay attention to them? 



The </summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/5727098239666740535/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2012/11/how-to-get-your-work-publishedon-high_18.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/5727098239666740535'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/5727098239666740535'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2012/11/how-to-get-your-work-publishedon-high_18.html' title='How to get your work published...on high impact journals (Part II)'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-465676613529048504</id><published>2012-11-10T10:29:00.001-08:00</published><updated>2012-11-10T10:31:38.666-08:00</updated><category scheme="http://www.blogger.com/atom/ns#" term="research proposal"/><category scheme="http://www.blogger.com/atom/ns#" term="SciFinder"/><category scheme="http://www.blogger.com/atom/ns#" term="tips and tricks"/><category scheme="http://www.blogger.com/atom/ns#" term="Web of Knowledge"/><title type='text'>Where do I find IDEAS for my research proposal?</title><summary type="text">Heya folks, 

To be perfectly honest, there is no easy answer to this question. 
More experienced researchers have told me they get ideas from their work
 (experience) as the years goes by and they know intuitively what they 
would like to study and what is commercially viable. What about the 
novices ...?

1. Start off by reading

As
 a professor once said ... there is NEVER too much research. </summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/465676613529048504/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2012/11/where-do-i-find-ideas-for-my-research.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/465676613529048504'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/465676613529048504'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2012/11/where-do-i-find-ideas-for-my-research.html' title='Where do I find IDEAS for my research proposal?'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-3879062719255591011</id><published>2012-11-03T01:08:00.000-07:00</published><updated>2012-11-18T08:40:50.502-08:00</updated><category scheme="http://www.blogger.com/atom/ns#" term="ACS"/><category scheme="http://www.blogger.com/atom/ns#" term="JACS"/><category scheme="http://www.blogger.com/atom/ns#" term="journals"/><category scheme="http://www.blogger.com/atom/ns#" term="nature"/><category scheme="http://www.blogger.com/atom/ns#" term="publications"/><category scheme="http://www.blogger.com/atom/ns#" term="science"/><title type='text'>How to get your work published...on high impact journals (Part I)</title><summary type="text">Heya folks,

This is a question that a budding researcher or (i hope?) a student will eventually ask. How do I get my work published in high visibility journals. To be honest, it can be both easy and difficult at the same time...

I&#39;ve had the privilege of attending a seminar conducted by @Dr. Joerg Heber, who is a senior editor from Nature materials. Here he provided some interesting advice on </summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/3879062719255591011/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2012/11/how-to-get-your-work-publishedon-high.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/3879062719255591011'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/3879062719255591011'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2012/11/how-to-get-your-work-publishedon-high.html' title='How to get your work published...on high impact journals (Part I)'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-909094720463245542</id><published>2012-10-30T11:29:00.003-07:00</published><updated>2012-11-10T10:33:36.868-08:00</updated><title type='text'>Can we do Science at home... Is it even possible?</title><summary type="text">Heya folks,

Most people associate research and all things science to the laboratory. And they think the laboratory is the place where all the scientists and research go and use all sorts of expensive, high tech gadgets to conduct studies that possibly impact our lives. Is it really true?

Well, its mostly true. Some experiments have to involve machines that are huge and cannot be easily moved </summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/909094720463245542/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2012/10/can-we-do-science-at-home-is-it-even.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/909094720463245542'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/909094720463245542'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2012/10/can-we-do-science-at-home-is-it-even.html' title='Can we do Science at home... Is it even possible?'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-6578906284743662395</id><published>2012-10-29T10:03:00.000-07:00</published><updated>2012-11-10T10:36:16.696-08:00</updated><title type='text'>What EXACTLY is computational chemistry simulations ...?</title><summary type="text">

















Heya folks,

This is a question that is commonly asked in the minds of aspiring researchers and students when they are introduced into theoretical or computational based chemistry. Is it easy or hard or just too plain crazy to understand?

Well, computational based chemistry does dabble in quantum mechanics and its definitely a complex subject that require one to be comfortable </summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/6578906284743662395/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2012/10/what-exactly-is-computational-chemistry.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/6578906284743662395'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/6578906284743662395'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2012/10/what-exactly-is-computational-chemistry.html' title='What EXACTLY is computational chemistry simulations ...?'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-3025267247210032865</id><published>2012-10-28T01:26:00.002-07:00</published><updated>2012-11-10T10:32:37.321-08:00</updated><category scheme="http://www.blogger.com/atom/ns#" term="article reviews"/><category scheme="http://www.blogger.com/atom/ns#" term="examples"/><category scheme="http://www.blogger.com/atom/ns#" term="how to"/><category scheme="http://www.blogger.com/atom/ns#" term="tips and tricks"/><category scheme="http://www.blogger.com/atom/ns#" term="website review"/><title type='text'>FoCUS!</title><summary type="text">

Heya folks,

The title says it all, this webpage will be somewhat focused and below are some of the items that I will strive to include on a regular basis.

Some of them such as &#39;tips and tricks&#39; will be posted as and when I pick up any or when I realise something might be useful to the wider audience. Others such as &#39;computational stuff/examples&#39; will be a more regular feature and a couple of </summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/3025267247210032865/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2012/10/focus.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/3025267247210032865'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/3025267247210032865'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2012/10/focus.html' title='FoCUS!'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry><entry><id>tag:blogger.com,1999:blog-4642350417253823263.post-265598678781386008</id><published>2012-10-26T07:36:00.002-07:00</published><updated>2012-10-29T23:41:58.819-07:00</updated><category scheme="http://www.blogger.com/atom/ns#" term="CASTEP"/><category scheme="http://www.blogger.com/atom/ns#" term="chem"/><category scheme="http://www.blogger.com/atom/ns#" term="dmol"/><category scheme="http://www.blogger.com/atom/ns#" term="simulations"/><category scheme="http://www.blogger.com/atom/ns#" term="vasp"/><title type='text'>Let&#39;s get this blog started</title><summary type="text">
 

Hey guys JohnHDchem here,

I am a (young?) theoretical chemist and I created this blog because I hope to offer come useful tips for follow novice simulations people who have a headache with the settings, option selections and stuff.

I certainly do not claim to be an expert in any way so the content in this blog are mainly my experiences and stuff which I have learnt from tutorials. If there </summary><link rel='replies' type='application/atom+xml' href='http://www.chemsimulations.com/feeds/265598678781386008/comments/default' title='Post Comments'/><link rel='replies' type='text/html' href='http://www.chemsimulations.com/2012/10/lets-get-this-blog-started.html#comment-form' title='0 Comments'/><link rel='edit' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/265598678781386008'/><link rel='self' type='application/atom+xml' href='http://www.blogger.com/feeds/4642350417253823263/posts/default/265598678781386008'/><link rel='alternate' type='text/html' href='http://www.chemsimulations.com/2012/10/lets-get-this-blog-started.html' title='Let&#39;s get this blog started'/><author><name>JohnHD</name><uri>http://www.blogger.com/profile/02201367650533626359</uri><email>noreply@blogger.com</email><gd:image rel='http://schemas.google.com/g/2005#thumbnail' width='31' height='16' src='//2.bp.blogspot.com/-1tARQLSM2xs/UKs348dFnGI/AAAAAAAAACA/9xM5qRpZITU/s149/1548626023.jpg'/></author><thr:total>0</thr:total></entry></feed>