Re: [ccp4bb] birefringent spacegroups

2008-06-13 Thread Philippe DUMAS
Thank you Ian for the comment !
Apparently, I was a bit too quick in my answer.
By the way, my mentioning of Fresnel's theory was of pure historical
interest and not at all to say that the whole story was written at that
time.

I went back to my Born  Wolf (some kind of a bible in the optics field)
and I am somewhat surprised of not seeing any comment on that topics. May be
the comments exist, but implicitly in the cited litterature...

Now, I am still wondering whether external stresses on biological crystals
could indeed induce such unexpected birefringence.

Philippe Dumas
IBMC-CNRS, UPR9002
15, rue René Descartes 67084 Strasbourg cedex
tel: +33 (0)3 88 41 70 02
[EMAIL PROTECTED]


-Message d'origine-
De : CCP4 bulletin board [mailto:[EMAIL PROTECTED] la part de Ian
Tickle
Envoyé : Thursday, June 12, 2008 9:20 PM
À : CCP4BB@JISCMAIL.AC.UK
Objet : Re: [ccp4bb] birefringent spacegroups


But it seems that Hendrik Lorentz was the first to realise that symmetry
breaking of the isotropy of the refractive index  other optical properties
could occur in cubic crystals at sufficiently short wavelength even in the
absence of a distorting force - the spatial-dispersion-induced
birefringence effect referred to in the paper.  Note that this is an
intrinsic effect, it has nothing to do with external stress, electric field
etc., and if you read the paper you'll see that such external effects were
specifically eliminated as the cause of the observed effect.

-- Ian

 -Original Message-
 From: [EMAIL PROTECTED]
 [mailto:[EMAIL PROTECTED] On Behalf Of Philippe DUMAS
 Sent: 12 June 2008 19:20
 To: Ian Tickle; CCP4BB@JISCMAIL.AC.UK
 Subject: RE: [ccp4bb] birefringent spacegroups

 Hello,

 A short comment of historical interest: the first theory about double
 refraction in crystals (with explicit calculation of the
 index ellipsoid)
 goes back to 3 memoirs by A. Fresnel in 1821 and 1822. So, we
 are even in
 older regions.

 This being said, in cubic crystals the index ellipsoid can
 only be a sphere.
 An so, no birefringence should exist (unless there is some
 external cause of
 anisotropy: mecanical stress, electric field,...). See Born  Wolff
 (principles of optics) p. 703. May be, our biological
 crystals might quite
 easily develop such stress birefringence...

 Philippe Dumas
 IBMC-CNRS, UPR9002
 15, rue René Descartes 67084 Strasbourg cedex
 tel: +33 (0)3 88 41 70 02
 [EMAIL PROTECTED]



 -Message d'origine-
 De : CCP4 bulletin board [mailto:[EMAIL PROTECTED] la
 part de Ian
 Tickle
 Envoyé : Thursday, June 12, 2008 7:19 PM
 À : CCP4BB@JISCMAIL.AC.UK
 Objet : Re: [ccp4bb] birefringent spacegroups


 PS in case you missed it, here's the bottom line from the paper:

 Interestingly, a cubic crystal has seven nonbirefringent
 axes, four in
 the 111
 directions and three in the 100 directions, with
 birefringence maxima
 in the twelve 110 directions.

 So it would appear that the optical properties of cubic crystals are
 *more* complicated than those of lower symmetry systems, not
 less! - and
 previous conclusions about isotropy of cubic crystals probably arose
 because the measurements were simply not precise enough (or
 not carried
 out at short enough wavelength) to detect the effect.  However the
 relevant theory goes back to Lorentz (1878) so it's not exactly new!

 Cheers

 -- Ian

  -Original Message-
  From: [EMAIL PROTECTED]
  [mailto:[EMAIL PROTECTED] On Behalf Of Ian Tickle
  Sent: 12 June 2008 17:50
  To: Ethan A Merritt; Jacob Keller
  Cc: CCP4BB@jiscmail.ac.uk
  Subject: RE: [ccp4bb] birefringent spacegroups
 
  Hi Ethan
 
  You could be right, see this paper:
 
 
 http://physics.nist.gov/Divisions/Div842/Gp2/DUVMatChar/PDF/In
 tBiref.pdf
 
  Cheers
 
  -- Ian
 
 
   -Original Message-
   From: [EMAIL PROTECTED]
   [mailto:[EMAIL PROTECTED] On Behalf Of Ethan A Merritt
   Sent: 12 June 2008 15:46
   To: Multiple recipients
   Cc: CCP4BB@jiscmail.ac.uk
   Subject: Re: [ccp4bb] birefringent spacegroups
  
   On Wednesday 11 June 2008 23:55, Robin Owen wrote:
Hi Jacob,
   
The birefringence of a crystal is determined by a three
  dimensional
shape (the indicatrix) describing how refractive index
  varies with
direction within the crystal. You can think of this as a 3d
   ellipse and
the birefringence is given by the difference in length of
   the two axes
of the ellipse 'seen' by light as it passes through the crystal.
   
The orientation and shape of the indicatrix are constrained
   by the point
group symmetry of the crystal. In the case of cubic
 crystals, the
indicatrix is characterised by four 3-fold axes. The
   indicatrix for all
cubic crystals is thus a sphere and cubic crystals are
   non-birefringent.
Hexagonal, trigonal and tetragonal crystals are uniaxial and the
indicatrix is an ellipsoid of revolution
- there is one direction in which the crystal appears
   non-birefringent.
Orthorhombic, monoclinic

Re: [ccp4bb] birefringent spacegroups

2008-06-13 Thread Ian Tickle
  -Original Message-
 From: [EMAIL PROTECTED] 
 [mailto:[EMAIL PROTECTED] On Behalf Of Ethan Merritt
 Sent: 12 June 2008 19:41
 To: Multiple recipients
 Cc: CCP4BB@jiscmail.ac.uk
 Subject: Re: [ccp4bb] birefringent spacegroups
 
 But the ellipsoid is only a convenient approximation based on 
 properties
 evaluated at 3 orthogonal axes.  It is not a complete 
 description, it is
 simple model.  More complex models may describe more complex 
 properties,
 as is the case in the paper that Ian refers to.  
 
 If birefringence is formally defined in terms of the approximating 
 ellipsoid, this is correct.  I do not know if this is the case or not.
 But if birefringence is generalized to mean optical index varies with
 incident illumination vector then I believe all protein crystals
 are birefringent.
 
 I may be talking nonsense here. If so, I welcome the opportunity to
 learn better. 
 
   Ethan


No I think you're quite right, birefringence clearly refers to any case
where the refractive index is anisotropic for any general pair of
directions, not just in specific orthogonal directions.  In any case the
birefringent direction [110] in cubic is orthogonal to the
non-birefringent direction [001] so the old definition is still
applicable anyway.  BTW here's a patent issued for a method to get
around the problems in lithographic fabrication of semiconductors caused
by optical elements made from birefringent cubic crystals, so it's a
very real problem, not just one of theoretical interest!

http://www.patentstorm.us/patents/6844972/fulltext.html

Cheers

-- Ian


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Re: [ccp4bb] birefringent spacegroups

2008-06-13 Thread Ian Tickle
PS I found a nice presentation from the NIST group explaining the theory
behind the cubic birefringence effect:
http://math.nist.gov/mcsd/Seminars/2004/2004-06-10-shirley-presentation.
pdf .  Slide 33 has some nice graphics summarising the birefringence
effect in all crystal systems.

-- Ian

 -Original Message-
 From: [EMAIL PROTECTED] 
 [mailto:[EMAIL PROTECTED] On Behalf Of Ian Tickle
 Sent: 13 June 2008 11:20
 To: Ethan Merritt
 Cc: CCP4BB@jiscmail.ac.uk
 Subject: RE: [ccp4bb] birefringent spacegroups
 
 
   -Original Message-
  From: [EMAIL PROTECTED] 
  [mailto:[EMAIL PROTECTED] On Behalf Of Ethan Merritt
  Sent: 12 June 2008 19:41
  To: Multiple recipients
  Cc: CCP4BB@jiscmail.ac.uk
  Subject: Re: [ccp4bb] birefringent spacegroups
  
  But the ellipsoid is only a convenient approximation based on 
  properties
  evaluated at 3 orthogonal axes.  It is not a complete 
  description, it is
  simple model.  More complex models may describe more complex 
  properties,
  as is the case in the paper that Ian refers to.  
  
  If birefringence is formally defined in terms of the 
 approximating 
  ellipsoid, this is correct.  I do not know if this is the 
 case or not.
  But if birefringence is generalized to mean optical index 
 varies with
  incident illumination vector then I believe all protein crystals
  are birefringent.
  
  I may be talking nonsense here. If so, I welcome the opportunity to
  learn better. 
  
  Ethan
 
 
 No I think you're quite right, birefringence clearly refers 
 to any case
 where the refractive index is anisotropic for any general pair of
 directions, not just in specific orthogonal directions.  In 
 any case the
 birefringent direction [110] in cubic is orthogonal to the
 non-birefringent direction [001] so the old definition is still
 applicable anyway.  BTW here's a patent issued for a method to get
 around the problems in lithographic fabrication of 
 semiconductors caused
 by optical elements made from birefringent cubic crystals, so it's a
 very real problem, not just one of theoretical interest!
 
 http://www.patentstorm.us/patents/6844972/fulltext.html
 
 Cheers
 
 -- Ian
 
 
 Disclaimer
 This communication is confidential and may contain privileged 
 information intended solely for the named addressee(s). It 
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 it has been sent. If you are not the intended recipient you 
 must not review, use, disclose, copy, distribute or take any 
 action in reliance upon it. If you have received this 
 communication in error, please notify Astex Therapeutics Ltd 
 by emailing [EMAIL PROTECTED] and destroy all 
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 Astex Therapeutics Ltd monitors, controls and protects all 
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 Therapeutics Ltd only send and receive e-mails on the basis 
 that the Company is not liable for any such alteration or any 
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 Astex Therapeutics Ltd., Registered in England at 436 
 Cambridge Science Park, Cambridge CB4 0QA under number 3751674
 
 


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Re: [ccp4bb] birefringent spacegroups

2008-06-12 Thread Robin Owen

Hi Jacob,

The birefringence of a crystal is determined by a three dimensional 
shape (the indicatrix) describing how refractive index varies with 
direction within the crystal. You can think of this as a 3d ellipse and 
the birefringence is given by the difference in length of the two axes 
of the ellipse 'seen' by light as it passes through the crystal.


The orientation and shape of the indicatrix are constrained by the point 
group symmetry of the crystal. In the case of cubic crystals, the 
indicatrix is characterised by four 3-fold axes. The indicatrix for all 
cubic crystals is thus a sphere and cubic crystals are non-birefringent. 
Hexagonal, trigonal and tetragonal crystals are uniaxial and the 
indicatrix is an ellipsoid of revolution
- there is one direction in which the crystal appears non-birefringent. 
Orthorhombic, monoclinic and triclinic systems are biaxial -two axes in 
which the crystal appears non-birefringent.


A good reference is
Nye (1984). Physical Properties of crystals. Their representation by 
tensors and matrices. Clarendon Press, Oxford.
There is a more detailed list of space groups and their tensor optical 
properties in there I think.


Cheers,
Robin


Jacob Keller wrote:

Dear Crystallographers,

is there a list somewhere of spacegroups which can and cannot be 
birefringent? Upon what feature of the spacegroup does this depend?


Jacob Keller

***
Jacob Pearson Keller
Northwestern University
Medical Scientist Training Program
Dallos Laboratory
F. Searle 1-240
2240 Campus Drive
Evanston IL 60208
lab: 847.491.2438
cel: 773.608.9185
email: [EMAIL PROTECTED]
*** 


Re: [ccp4bb] birefringent spacegroups

2008-06-12 Thread Savvas Savvides
Hi Jacob,
Chek out Section 2 in the following paper:

Echalier et al. (2004) Assessing crystallization droplets uding
birefringence.
Acta Cryst D60, 696-702.

It offers a very effective summary of the physical basis of crystal
birefringence and reiterates the classification of crystal optics based
on isotropic, uniaxial and biaxial systems. My understanding is that a
favorable crystal orientation with respect to the direction of view is
important for being able to observe appreciable birefringence from
uniaxial and biaxial crystals. This can be especially tricky to get from
biaxial crystals, i.e. crystals with orthorhombic or monoclinic or
triclinic point-group symmetry, projecting their optically anisotropic
axis in the plane of the view. Crystals with cubic symmetry are
optically isotropic and are therefore not birefringent.

Best wishes
Savvas




-Original Message-
From: CCP4 bulletin board [mailto:[EMAIL PROTECTED] On Behalf Of
Jacob Keller
Sent: Thursday, June 12, 2008 2:33 AM
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] birefringent spacegroups


Dear Crystallographers,

is there a list somewhere of spacegroups which can and cannot be 
birefringent? Upon what feature of the spacegroup does this depend?

Jacob Keller

***
Jacob Pearson Keller
Northwestern University
Medical Scientist Training Program
Dallos Laboratory
F. Searle 1-240
2240 Campus Drive
Evanston IL 60208
lab: 847.491.2438
cel: 773.608.9185
email: [EMAIL PROTECTED]
*** 


Re: [ccp4bb] birefringent spacegroups

2008-06-12 Thread Ethan A Merritt
On Wednesday 11 June 2008 23:55, Robin Owen wrote:
 Hi Jacob,
 
 The birefringence of a crystal is determined by a three dimensional 
 shape (the indicatrix) describing how refractive index varies with 
 direction within the crystal. You can think of this as a 3d ellipse and 
 the birefringence is given by the difference in length of the two axes 
 of the ellipse 'seen' by light as it passes through the crystal.

 The orientation and shape of the indicatrix are constrained by the point 
 group symmetry of the crystal. In the case of cubic crystals, the 
 indicatrix is characterised by four 3-fold axes. The indicatrix for all 
 cubic crystals is thus a sphere and cubic crystals are non-birefringent. 
 Hexagonal, trigonal and tetragonal crystals are uniaxial and the 
 indicatrix is an ellipsoid of revolution
 - there is one direction in which the crystal appears non-birefringent. 
 Orthorhombic, monoclinic and triclinic systems are biaxial -two axes in 
 which the crystal appears non-birefringent.

I have wondered about this in the past.
That argument only appears to hold if birefringent is taken to mean
different optical index at two angles 90 degrees apart.  I think
even in a cubic crystal you can find non-equivalent directions if you
are not limited to a right angle between the two vectors.  Does this
not count as birefringence?  Or am I misunderstanding the definition?

Ethan

 and then there's the issue of anomalous dispersion...

 A good reference is
 Nye (1984). Physical Properties of crystals. Their representation by 
 tensors and matrices. Clarendon Press, Oxford.
 There is a more detailed list of space groups and their tensor optical 
 properties in there I think.
 
 Cheers,
 Robin
 
 
 Jacob Keller wrote:
  Dear Crystallographers,
 
  is there a list somewhere of spacegroups which can and cannot be 
  birefringent? Upon what feature of the spacegroup does this depend?
 
  Jacob Keller
 
  ***
  Jacob Pearson Keller
  Northwestern University
  Medical Scientist Training Program
  Dallos Laboratory
  F. Searle 1-240
  2240 Campus Drive
  Evanston IL 60208
  lab: 847.491.2438
  cel: 773.608.9185
  email: [EMAIL PROTECTED]
  *** 
 

-- 
Ethan A Merritt
Biomolecular Structure Center
University of Washington, Seattle 98195-7742


Re: [ccp4bb] birefringent spacegroups

2008-06-12 Thread Ian Tickle
Hi Ethan

You could be right, see this paper:

http://physics.nist.gov/Divisions/Div842/Gp2/DUVMatChar/PDF/IntBiref.pdf

Cheers

-- Ian
 

 -Original Message-
 From: [EMAIL PROTECTED] 
 [mailto:[EMAIL PROTECTED] On Behalf Of Ethan A Merritt
 Sent: 12 June 2008 15:46
 To: Multiple recipients
 Cc: CCP4BB@jiscmail.ac.uk
 Subject: Re: [ccp4bb] birefringent spacegroups
 
 On Wednesday 11 June 2008 23:55, Robin Owen wrote:
  Hi Jacob,
  
  The birefringence of a crystal is determined by a three dimensional 
  shape (the indicatrix) describing how refractive index varies with 
  direction within the crystal. You can think of this as a 3d 
 ellipse and 
  the birefringence is given by the difference in length of 
 the two axes 
  of the ellipse 'seen' by light as it passes through the crystal.
 
  The orientation and shape of the indicatrix are constrained 
 by the point 
  group symmetry of the crystal. In the case of cubic crystals, the 
  indicatrix is characterised by four 3-fold axes. The 
 indicatrix for all 
  cubic crystals is thus a sphere and cubic crystals are 
 non-birefringent. 
  Hexagonal, trigonal and tetragonal crystals are uniaxial and the 
  indicatrix is an ellipsoid of revolution
  - there is one direction in which the crystal appears 
 non-birefringent. 
  Orthorhombic, monoclinic and triclinic systems are biaxial 
 -two axes in 
  which the crystal appears non-birefringent.
 
 I have wondered about this in the past.
 That argument only appears to hold if birefringent is taken to mean
 different optical index at two angles 90 degrees apart.  I think
 even in a cubic crystal you can find non-equivalent directions if you
 are not limited to a right angle between the two vectors.  Does this
 not count as birefringence?  Or am I misunderstanding the definition?
 
   Ethan
 
  and then there's the issue of anomalous dispersion...
 
  A good reference is
  Nye (1984). Physical Properties of crystals. Their 
 representation by 
  tensors and matrices. Clarendon Press, Oxford.
  There is a more detailed list of space groups and their 
 tensor optical 
  properties in there I think.
  
  Cheers,
  Robin
  
  
  Jacob Keller wrote:
   Dear Crystallographers,
  
   is there a list somewhere of spacegroups which can and cannot be 
   birefringent? Upon what feature of the spacegroup does 
 this depend?
  
   Jacob Keller
  
   ***
   Jacob Pearson Keller
   Northwestern University
   Medical Scientist Training Program
   Dallos Laboratory
   F. Searle 1-240
   2240 Campus Drive
   Evanston IL 60208
   lab: 847.491.2438
   cel: 773.608.9185
   email: [EMAIL PROTECTED]
   *** 
  
 
 -- 
 Ethan A Merritt
 Biomolecular Structure Center
 University of Washington, Seattle 98195-7742
 
 


Disclaimer
This communication is confidential and may contain privileged information 
intended solely for the named addressee(s). It may not be used or disclosed 
except for the purpose for which it has been sent. If you are not the intended 
recipient you must not review, use, disclose, copy, distribute or take any 
action in reliance upon it. If you have received this communication in error, 
please notify Astex Therapeutics Ltd by emailing [EMAIL PROTECTED] and destroy 
all copies of the message and any attached documents. 
Astex Therapeutics Ltd monitors, controls and protects all its messaging 
traffic in compliance with its corporate email policy. The Company accepts no 
liability or responsibility for any onward transmission or use of emails and 
attachments having left the Astex Therapeutics domain.  Unless expressly 
stated, opinions in this message are those of the individual sender and not of 
Astex Therapeutics Ltd. The recipient should check this email and any 
attachments for the presence of computer viruses. Astex Therapeutics Ltd 
accepts no liability for damage caused by any virus transmitted by this email. 
E-mail is susceptible to data corruption, interception, unauthorized amendment, 
and tampering, Astex Therapeutics Ltd only send and receive e-mails on the 
basis that the Company is not liable for any such alteration or any 
consequences thereof.
Astex Therapeutics Ltd., Registered in England at 436 Cambridge Science Park, 
Cambridge CB4 0QA under number 3751674


Re: [ccp4bb] birefringent spacegroups

2008-06-12 Thread Ian Tickle
PS in case you missed it, here's the bottom line from the paper:

Interestingly, a cubic crystal has seven nonbirefringent axes, four in
the 111
directions and three in the 100 directions, with birefringence maxima
in the twelve 110 directions.

So it would appear that the optical properties of cubic crystals are
*more* complicated than those of lower symmetry systems, not less! - and
previous conclusions about isotropy of cubic crystals probably arose
because the measurements were simply not precise enough (or not carried
out at short enough wavelength) to detect the effect.  However the
relevant theory goes back to Lorentz (1878) so it's not exactly new!

Cheers

-- Ian

 -Original Message-
 From: [EMAIL PROTECTED] 
 [mailto:[EMAIL PROTECTED] On Behalf Of Ian Tickle
 Sent: 12 June 2008 17:50
 To: Ethan A Merritt; Jacob Keller
 Cc: CCP4BB@jiscmail.ac.uk
 Subject: RE: [ccp4bb] birefringent spacegroups
 
 Hi Ethan
 
 You could be right, see this paper:
 

http://physics.nist.gov/Divisions/Div842/Gp2/DUVMatChar/PDF/IntBiref.pdf
 
 Cheers
 
 -- Ian
  
 
  -Original Message-
  From: [EMAIL PROTECTED] 
  [mailto:[EMAIL PROTECTED] On Behalf Of Ethan A Merritt
  Sent: 12 June 2008 15:46
  To: Multiple recipients
  Cc: CCP4BB@jiscmail.ac.uk
  Subject: Re: [ccp4bb] birefringent spacegroups
  
  On Wednesday 11 June 2008 23:55, Robin Owen wrote:
   Hi Jacob,
   
   The birefringence of a crystal is determined by a three 
 dimensional 
   shape (the indicatrix) describing how refractive index 
 varies with 
   direction within the crystal. You can think of this as a 3d 
  ellipse and 
   the birefringence is given by the difference in length of 
  the two axes 
   of the ellipse 'seen' by light as it passes through the crystal.
  
   The orientation and shape of the indicatrix are constrained 
  by the point 
   group symmetry of the crystal. In the case of cubic crystals, the 
   indicatrix is characterised by four 3-fold axes. The 
  indicatrix for all 
   cubic crystals is thus a sphere and cubic crystals are 
  non-birefringent. 
   Hexagonal, trigonal and tetragonal crystals are uniaxial and the 
   indicatrix is an ellipsoid of revolution
   - there is one direction in which the crystal appears 
  non-birefringent. 
   Orthorhombic, monoclinic and triclinic systems are biaxial 
  -two axes in 
   which the crystal appears non-birefringent.
  
  I have wondered about this in the past.
  That argument only appears to hold if birefringent is 
 taken to mean
  different optical index at two angles 90 degrees apart.  I think
  even in a cubic crystal you can find non-equivalent 
 directions if you
  are not limited to a right angle between the two vectors.  Does this
  not count as birefringence?  Or am I misunderstanding the 
 definition?
  
  Ethan
  
   and then there's the issue of anomalous dispersion...
  
   A good reference is
   Nye (1984). Physical Properties of crystals. Their 
  representation by 
   tensors and matrices. Clarendon Press, Oxford.
   There is a more detailed list of space groups and their 
  tensor optical 
   properties in there I think.
   
   Cheers,
   Robin
   
   
   Jacob Keller wrote:
Dear Crystallographers,
   
is there a list somewhere of spacegroups which can and 
 cannot be 
birefringent? Upon what feature of the spacegroup does 
  this depend?
   
Jacob Keller
   
***
Jacob Pearson Keller
Northwestern University
Medical Scientist Training Program
Dallos Laboratory
F. Searle 1-240
2240 Campus Drive
Evanston IL 60208
lab: 847.491.2438
cel: 773.608.9185
email: [EMAIL PROTECTED]
*** 
   
  
  -- 
  Ethan A Merritt
  Biomolecular Structure Center
  University of Washington, Seattle 98195-7742
  
  
 
 
 Disclaimer
 This communication is confidential and may contain privileged 
 information intended solely for the named addressee(s). It 
 may not be used or disclosed except for the purpose for which 
 it has been sent. If you are not the intended recipient you 
 must not review, use, disclose, copy, distribute or take any 
 action in reliance upon it. If you have received this 
 communication in error, please notify Astex Therapeutics Ltd 
 by emailing [EMAIL PROTECTED] and destroy all 
 copies of the message and any attached documents. 
 Astex Therapeutics Ltd monitors, controls and protects all 
 its messaging traffic in compliance with its corporate email 
 policy. The Company accepts no liability or responsibility 
 for any onward transmission or use of emails and attachments 
 having left the Astex Therapeutics domain.  Unless expressly 
 stated, opinions in this message are those of the individual 
 sender and not of Astex Therapeutics Ltd. The recipient 
 should check this email and any attachments for the presence 
 of computer viruses. Astex Therapeutics Ltd accepts no 
 liability for damage caused

Re: [ccp4bb] birefringent spacegroups

2008-06-12 Thread Ethan Merritt
On Thursday 12 June 2008 11:19, Philippe DUMAS wrote:
 Hello,
 
 A short comment of historical interest: the first theory about double
 refraction in crystals (with explicit calculation of the index ellipsoid)
 goes back to 3 memoirs by A. Fresnel in 1821 and 1822. So, we are even in
 older regions.
 
 This being said, in cubic crystals the index ellipsoid can only be a sphere.

But the ellipsoid is only a convenient approximation based on properties
evaluated at 3 orthogonal axes.  It is not a complete description, it is
simple model.  More complex models may describe more complex properties,
as is the case in the paper that Ian refers to.  

 And so, no birefringence should exist 

If birefringence is formally defined in terms of the approximating 
ellipsoid, this is correct.  I do not know if this is the case or not.
But if birefringence is generalized to mean optical index varies with
incident illumination vector then I believe all protein crystals
are birefringent.

I may be talking nonsense here. If so, I welcome the opportunity to
learn better. 

Ethan

 (unless there is some external cause of 
 anisotropy: mecanical stress, electric field,...). See Born  Wolff
 (principles of optics) p. 703. May be, our biological crystals might quite
 easily develop such stress birefringence...

 
 Philippe Dumas
 IBMC-CNRS, UPR9002
 15, rue René Descartes 67084 Strasbourg cedex
 tel: +33 (0)3 88 41 70 02
 [EMAIL PROTECTED]
 
 
 
 -Message d'origine-
 De : CCP4 bulletin board [mailto:[EMAIL PROTECTED] la part de Ian
 Tickle
 Envoyé : Thursday, June 12, 2008 7:19 PM
 À : CCP4BB@JISCMAIL.AC.UK
 Objet : Re: [ccp4bb] birefringent spacegroups
 
 
 PS in case you missed it, here's the bottom line from the paper:
 
 Interestingly, a cubic crystal has seven nonbirefringent axes, four in
 the 111
 directions and three in the 100 directions, with birefringence maxima
 in the twelve 110 directions.
 
 So it would appear that the optical properties of cubic crystals are
 *more* complicated than those of lower symmetry systems, not less! - and
 previous conclusions about isotropy of cubic crystals probably arose
 because the measurements were simply not precise enough (or not carried
 out at short enough wavelength) to detect the effect.  However the
 relevant theory goes back to Lorentz (1878) so it's not exactly new!
 
 Cheers
 
 -- Ian
 
  -Original Message-
  From: [EMAIL PROTECTED]
  [mailto:[EMAIL PROTECTED] On Behalf Of Ian Tickle
  Sent: 12 June 2008 17:50
  To: Ethan A Merritt; Jacob Keller
  Cc: CCP4BB@jiscmail.ac.uk
  Subject: RE: [ccp4bb] birefringent spacegroups
 
  Hi Ethan
 
  You could be right, see this paper:
 
 
 http://physics.nist.gov/Divisions/Div842/Gp2/DUVMatChar/PDF/IntBiref.pdf
 
  Cheers
 
  -- Ian
 
 
   -Original Message-
   From: [EMAIL PROTECTED]
   [mailto:[EMAIL PROTECTED] On Behalf Of Ethan A Merritt
   Sent: 12 June 2008 15:46
   To: Multiple recipients
   Cc: CCP4BB@jiscmail.ac.uk
   Subject: Re: [ccp4bb] birefringent spacegroups
  
   On Wednesday 11 June 2008 23:55, Robin Owen wrote:
Hi Jacob,
   
The birefringence of a crystal is determined by a three
  dimensional
shape (the indicatrix) describing how refractive index
  varies with
direction within the crystal. You can think of this as a 3d
   ellipse and
the birefringence is given by the difference in length of
   the two axes
of the ellipse 'seen' by light as it passes through the crystal.
   
The orientation and shape of the indicatrix are constrained
   by the point
group symmetry of the crystal. In the case of cubic crystals, the
indicatrix is characterised by four 3-fold axes. The
   indicatrix for all
cubic crystals is thus a sphere and cubic crystals are
   non-birefringent.
Hexagonal, trigonal and tetragonal crystals are uniaxial and the
indicatrix is an ellipsoid of revolution
- there is one direction in which the crystal appears
   non-birefringent.
Orthorhombic, monoclinic and triclinic systems are biaxial
   -two axes in
which the crystal appears non-birefringent.
  
   I have wondered about this in the past.
   That argument only appears to hold if birefringent is
  taken to mean
   different optical index at two angles 90 degrees apart.  I think
   even in a cubic crystal you can find non-equivalent
  directions if you
   are not limited to a right angle between the two vectors.  Does this
   not count as birefringence?  Or am I misunderstanding the
  definition?
  
 Ethan
  
and then there's the issue of anomalous dispersion...
  
A good reference is
Nye (1984). Physical Properties of crystals. Their
   representation by
tensors and matrices. Clarendon Press, Oxford.
There is a more detailed list of space groups and their
   tensor optical
properties in there I think.
   
Cheers,
Robin
   
   
Jacob Keller wrote:
 Dear Crystallographers,

 is there a list somewhere

Re: [ccp4bb] birefringent spacegroups

2008-06-12 Thread Ian Tickle
But it seems that Hendrik Lorentz was the first to realise that symmetry 
breaking of the isotropy of the refractive index  other optical properties 
could occur in cubic crystals at sufficiently short wavelength even in the 
absence of a distorting force - the spatial-dispersion-induced birefringence 
effect referred to in the paper.  Note that this is an intrinsic effect, it has 
nothing to do with external stress, electric field etc., and if you read the 
paper you'll see that such external effects were specifically eliminated as the 
cause of the observed effect.

-- Ian

 -Original Message-
 From: [EMAIL PROTECTED] 
 [mailto:[EMAIL PROTECTED] On Behalf Of Philippe DUMAS
 Sent: 12 June 2008 19:20
 To: Ian Tickle; CCP4BB@JISCMAIL.AC.UK
 Subject: RE: [ccp4bb] birefringent spacegroups
 
 Hello,
 
 A short comment of historical interest: the first theory about double
 refraction in crystals (with explicit calculation of the 
 index ellipsoid)
 goes back to 3 memoirs by A. Fresnel in 1821 and 1822. So, we 
 are even in
 older regions.
 
 This being said, in cubic crystals the index ellipsoid can 
 only be a sphere.
 An so, no birefringence should exist (unless there is some 
 external cause of
 anisotropy: mecanical stress, electric field,...). See Born  Wolff
 (principles of optics) p. 703. May be, our biological 
 crystals might quite
 easily develop such stress birefringence...
 
 Philippe Dumas
 IBMC-CNRS, UPR9002
 15, rue René Descartes 67084 Strasbourg cedex
 tel: +33 (0)3 88 41 70 02
 [EMAIL PROTECTED]
 
 
 
 -Message d'origine-
 De : CCP4 bulletin board [mailto:[EMAIL PROTECTED] la 
 part de Ian
 Tickle
 Envoyé : Thursday, June 12, 2008 7:19 PM
 À : CCP4BB@JISCMAIL.AC.UK
 Objet : Re: [ccp4bb] birefringent spacegroups
 
 
 PS in case you missed it, here's the bottom line from the paper:
 
 Interestingly, a cubic crystal has seven nonbirefringent 
 axes, four in
 the 111
 directions and three in the 100 directions, with 
 birefringence maxima
 in the twelve 110 directions.
 
 So it would appear that the optical properties of cubic crystals are
 *more* complicated than those of lower symmetry systems, not 
 less! - and
 previous conclusions about isotropy of cubic crystals probably arose
 because the measurements were simply not precise enough (or 
 not carried
 out at short enough wavelength) to detect the effect.  However the
 relevant theory goes back to Lorentz (1878) so it's not exactly new!
 
 Cheers
 
 -- Ian
 
  -Original Message-
  From: [EMAIL PROTECTED]
  [mailto:[EMAIL PROTECTED] On Behalf Of Ian Tickle
  Sent: 12 June 2008 17:50
  To: Ethan A Merritt; Jacob Keller
  Cc: CCP4BB@jiscmail.ac.uk
  Subject: RE: [ccp4bb] birefringent spacegroups
 
  Hi Ethan
 
  You could be right, see this paper:
 
 
 http://physics.nist.gov/Divisions/Div842/Gp2/DUVMatChar/PDF/In
 tBiref.pdf
 
  Cheers
 
  -- Ian
 
 
   -Original Message-
   From: [EMAIL PROTECTED]
   [mailto:[EMAIL PROTECTED] On Behalf Of Ethan A Merritt
   Sent: 12 June 2008 15:46
   To: Multiple recipients
   Cc: CCP4BB@jiscmail.ac.uk
   Subject: Re: [ccp4bb] birefringent spacegroups
  
   On Wednesday 11 June 2008 23:55, Robin Owen wrote:
Hi Jacob,
   
The birefringence of a crystal is determined by a three
  dimensional
shape (the indicatrix) describing how refractive index
  varies with
direction within the crystal. You can think of this as a 3d
   ellipse and
the birefringence is given by the difference in length of
   the two axes
of the ellipse 'seen' by light as it passes through the crystal.
   
The orientation and shape of the indicatrix are constrained
   by the point
group symmetry of the crystal. In the case of cubic 
 crystals, the
indicatrix is characterised by four 3-fold axes. The
   indicatrix for all
cubic crystals is thus a sphere and cubic crystals are
   non-birefringent.
Hexagonal, trigonal and tetragonal crystals are uniaxial and the
indicatrix is an ellipsoid of revolution
- there is one direction in which the crystal appears
   non-birefringent.
Orthorhombic, monoclinic and triclinic systems are biaxial
   -two axes in
which the crystal appears non-birefringent.
  
   I have wondered about this in the past.
   That argument only appears to hold if birefringent is
  taken to mean
   different optical index at two angles 90 degrees apart.  I think
   even in a cubic crystal you can find non-equivalent
  directions if you
   are not limited to a right angle between the two vectors. 
  Does this
   not count as birefringence?  Or am I misunderstanding the
  definition?
  
 Ethan
  
and then there's the issue of anomalous dispersion...
  
A good reference is
Nye (1984). Physical Properties of crystals. Their
   representation by
tensors and matrices. Clarendon Press, Oxford.
There is a more detailed list of space groups and their
   tensor optical
properties in there I think.
   
Cheers

[ccp4bb] birefringent spacegroups

2008-06-11 Thread Jacob Keller

Dear Crystallographers,

is there a list somewhere of spacegroups which can and cannot be 
birefringent? Upon what feature of the spacegroup does this depend?


Jacob Keller

***
Jacob Pearson Keller
Northwestern University
Medical Scientist Training Program
Dallos Laboratory
F. Searle 1-240
2240 Campus Drive
Evanston IL 60208
lab: 847.491.2438
cel: 773.608.9185
email: [EMAIL PROTECTED]
*** 


Re: [ccp4bb] birefringent spacegroups

2008-06-11 Thread William G. Scott
All cubic crystals, as far as I am aware, will not birefringe. All others
can (but it may be weak for reasons that don't depend on symmetry).

On Wed, Jun 11, 2008 at 5:33 PM, Jacob Keller [EMAIL PROTECTED]
wrote:

 Dear Crystallographers,

 is there a list somewhere of spacegroups which can and cannot be
 birefringent? Upon what feature of the spacegroup does this depend?

 Jacob Keller

 ***
 Jacob Pearson Keller
 Northwestern University
 Medical Scientist Training Program
 Dallos Laboratory
 F. Searle 1-240
 2240 Campus Drive
 Evanston IL 60208
 lab: 847.491.2438
 cel: 773.608.9185
 email: [EMAIL PROTECTED]
 ***




-- 
-


William G. Scott

contact info: http://chemistry.ucsc.edu/~wgscott

Please reply to: [EMAIL PROTECTED]